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caprylaldehyde

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keemiline ühend

Välised allikad

Freebase
/m/03d57cp[1]
Reaxys registry number
1744086[2]
ZVG number
40630
PubChem CID
454[3][4]
DSSTOX compound identifier
DTXCID701643
UniChem compound ID
224463[5]
PDB ligand ID
OYA
PesticideInfo chemical ID
PRI862
UNII
XGE9999H19[6][4]
KEGG ID
C01545
NSC number
1508
8969
OpenAlex ID
C2778744836[7]
ChEMBL ID
CHEMBL18407[8]
LIPID MAPS ID
LMFA06000028[9]
Nikkaji ID
J2.504F
InChIKey
NUJGJRNETVAIRJ-UHFFFAOYSA-N[3][10]
Cannabis Database ID
000172[11]
Human Metabolome Database ID
HMDB0001140[12][4]
PDB structure ID
2QHU[13]
5AZP[14]
ChEBI ID
17935[8][15]

mapping relation type: täpne vaste

DSSTox substance ID
DTXSID3021643[16][4]
CAS Registry Number
124-13-0[6][17]
CosIng number
40518[18]
J-GLOBAL ID
200907024822615690
Gmelin number
101464
SureChEMBL ID
SCHEMBL28601[12][4]
NMRShiftDB structure ID
20031905[4]
Microsoft Academic ID
2778744836
EC number
204-683-8[6]
ECHA Substance Infocard ID
100.004.259[19]
SwissLipids ID
SLM:000389951[20][4]
AICS Chemical ID (BEING DELETED)
3532
KNApSAcK ID
C00030880[2][12][4]
JECFA number
98[21]
UM-BBD compound ID
c0046
FL number
05.009[22]
ChemSpider ID
441[23]
JECFA database ID
3904
InChI
InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h8H,2-7H2,1H3[3]
CAMEO Chemicals ID
4108
MassBank accession ID
MSBNK-Fac_Eng_Univ_Tokyo-JP001483
MSBNK-Fac_Eng_Univ_Tokyo-JP008766
MSBNK-Fac_Eng_Univ_Tokyo-JP009326
MSBNK-Fac_Eng_Univ_Tokyo-JP008682
SPLASH
splash10-052f-9000000000-5116ccc02f51ccb0e86a
splash10-052f-9000000000-b395bc62397f2d3ead7d
splash10-000x-9000000000-70ec440a61fb95915131
splash10-000i-9200000000-f67b980d2d2a991b2179
splash10-000i-9300000000-2f4aa9d5b7cd47e5d002
splash10-0udi-4970000000-957d3c05049cd98e4df4
splash10-052f-9000000000-23d54ae7b45c372a7325
Probes And Drugs ID
PD166753
HSDB ID
5147[24]

üksikjuht nähtusest

type of chemical entity

mille alamklass

biogenic acyclic aldehyde
fatty aldehyde
alkanal

osa objektist

octanol dehydrogenase activity[25]

keemiline struktuur

mass/kaal

128,12 aatommassiühik[26]

chemical formula

C₈H₁₆O[3]

canonical SMILES

CCCCCCCC=O[3]

sulamistemperatuur

−23 Celsiuse skaala[27][28]

keemistemperatuur

171 Celsiuse skaala[28]

solubility

560 milligram per litre[28]

solvent: vesi

temperatuur: 25 Celsiuse skaala

flash point

52 Celsiuse skaala[28]

safety classification and labelling

NFPA 704: Standard System for the Identification of the Hazards of Materials for Emergency Response[28]

NFPA Health: 0

NFPA Fire: 2

NFPA Instability: 0

Globally Harmonized System of Classification and Labelling of Chemicals (GHS)[28]

GHS hazard pictogram: GHS02: leek, GHS07: hüüumärk, GHS09: keskkond

GHS hazard statement: H226, H315, H319, H411, H412

GHS precautionary statement: P210, P233, P240, P241, P242, P243, P264, P273, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P313, P337+P313, P362, P370+P378, P391, P403+P235, P501

GHS signal word: warning

found in taxon

Houttuynia cordata[29]
Anthemis aciphylla[30]
üheaastane puju[31]
Centaurea sessilis[32]
Harilik õlipuu[33][33][34]
harilik kaer[35][36]
Castanopsis cuspidata[37]
Ceraeochrysa smithi[38]
harilik arbuus[39]
Citrus grandis[40]
Pomelipuu[40]
Citrus ×iyo[41]
Harilik mandariinipuu[42]
Citrus wilsonii[43]
aedkoriander[44]
Daphne odora[45]
Metsporgand[46][47][48]
harilik vesikanep[49]
kollane lõhnasamblik[50]
põhja kaelkirjak[51]
Gymnodinium nagasakiense[52]
kevadkogrits[53]
virgiinia nõiapuu[54]
Helichrysum ambiguum[55]
harilik humal[56]
Microcitrus[57]
Micromeria biflora[58]
Pimenta racemosa[59]
Pittosporum tobira[60]
Platynereis dumerilii[61]
Polygala senega[62]
harilik mandlipuu[63]
Sideritis dichotoma[64]
süllane peiulill[65]
Thymus longicaulis[66]
Thymus zygioides[67]
mais[68][69]
ingver[70]
harilik vesiputk[71]
harilik aniis[72]
Sabine'i mänd[73]
Tanacetum annuum[74]
Vaccinium macrocarpon[75]
Etlingera elatior[76]
harilik kanep[77]
Greibipuu[40]
harilik pohl[78]
india mangopuu[79][80]
roosilõhnaline kuldjuur[81]
aedseller[82]
Teekummel[83]
teekummel[83]
räni-kardhein[84]
basiilik[85]
Teepõõsas[86]
Patrinia villosa[87]
Scaligeria lazica[88]
Kahvri laimipuu[89]
Eryngium foetidum[90]
Karenia mikimotoi[52]
Centaurea oltensis[32]
Vogtia annua[74]
Citrus × deliciosa[42]
Magus kirsipuu[63]
Heracleum stevenii[91]
Alpinia zerumbet[76]
Eryngium expansum[92]
Eryngium pandanifolium[92]
Eryngium rostratum[92]
Eryngium vesiculosum[92]
Chrysocephalum ambiguum[55]
Maasikas[93]

Commonsi kategooria

Octanal

Viited

  1. ↑ Freebase Data Dumps, 28. oktoober 2013
  2. ↑ 2,0 2,1 ChEBI, 19. oktoober 2016, inglise keel, octanal, 17935
  3. ↑ 3,0 3,1 3,2 3,3 3,4 PubChem, 19. november 2016, inglise keel, 454, Octanal
  4. ↑ 4,0 4,1 4,2 4,3 4,4 4,5 4,6 4,7 NUJGJRNETVAIRJ-UHFFFAOYSA-N, InChIKey
  5. ↑ UniChem
  6. ↑ 6,0 6,1 6,2 Global Substance Registration System, 19. november 2016, inglise keel, caprylaldehyde, XGE9999H19
  7. ↑ OpenAlex, 26. jaanuar 2022, https://docs.openalex.org/download-snapshot/snapshot-data-format
  8. ↑ 8,0 8,1 ChEMBL, 19. november 2016, inglise keel, OCTANAL, CHEMBL18407
  9. ↑ LIPID MAPS, http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download, 30. juuni 2018
  10. ↑ ChEBI release 2020-09-01
  11. ↑ Cannabis Database
  12. ↑ 12,0 12,1 12,2 inferred from InChIKey
  13. ↑ Protein Data Bank, 19. oktoober 2016, inglise keel, 2QHU, 2QHU
  14. ↑ Protein Data Bank, 19. oktoober 2016, inglise keel, 5AZP, 5AZP
  15. ↑ International Chemical Identifier, InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h8H,2-7H2,1H3
  16. ↑ Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
  17. ↑ CAS Common Chemistry, 9. aprill 2021, NUJGJRNETVAIRJ-UHFFFAOYSA-N, https://commonchemistry.cas.org/detail?cas_rn=124-13-0
  18. ↑ CosIng database, 28. detsember 2019, 40518, OCTANAL, CAS no.: 124-13-0
  19. ↑ ECHA Substance Infocard database, 27. detsember 2018, 100.004.259, Octanal, CAS no.: 124-13-0
  20. ↑ SwissLipids, https://www.swisslipids.org/#/downloads, 6. november 2021
  21. ↑ Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA), 13. mai 2021
  22. ↑ EFSA database, 23. jaanuar 2021, CAS no.: 124-13-0, 05.009
  23. ↑ ChemSpider, 19. november 2016, inglise keel, 441, Octanal
  24. ↑ Hazardous Substances Data Bank, 10. mai 2021, 28. oktoober 2019, Octylaldehyde, 5147
  25. ↑ Gene Ontology release 2020-05-02, Rhea release 113
  26. ↑ PubChem, 19. oktoober 2016, inglise keel, 454, Octanal
  27. ↑ Jean-Claude Bradley Open Melting Point Dataset
  28. ↑ 28,0 28,1 28,2 28,3 28,4 28,5 PubChem, 3. aprill 2020, 454
  29. ↑ Virucidal effects of the steam distillate from Houttuynia cordata and its components on HSV-1, influenza virus, and HIV.
  30. ↑ The essential oil constituents and antimicrobial activity of Anthemis aciphylla BOISS. var. discoidea BOISS.
  31. ↑ Composition of the essential oil from the root of Artemisia annua
  32. ↑ 32,0 32,1 Composition and antimicrobial activity of essential oils from Centaurea sessilis and Centaurea armena
  33. ↑ 33,0 33,1 Analysis of volatiles from callus cultures of olive Olea europaea
  34. ↑ Volatile constituents of commercial imported and domestic black-ripe table olives (Olea europaea).
  35. ↑ Oat leaf volatiles: possible insect attractants
  36. ↑ Volatile food attractants forOryzaephilus surinamensis (L.) from oats
  37. ↑ Volatile constituents of Castanopsis flower
  38. ↑ Chemical egg defense in a green lacewing (Ceraeochrysa smithi)
  39. ↑ Volatile flavor components of watermelon (Citrullus vulgaris).
  40. ↑ 40,0 40,1 40,2 Volatile Constituents of Several Varieties of Pummelos and Characteristics among Citrus Species.
  41. ↑ Composition of oxygenated compounds in peel oil from Citrus iyo and its variation during storage.
  42. ↑ 42,0 42,1 On the Genuineness of Essential Oils. Part XXX. Detection of Distilled Essential Oils Added to Cold-pressed Mandarin Essential Oils
  43. ↑ Essential oil of the leaves ofCitrus wilsonii
  44. ↑ Volatile compounds and odor characteristics of carbon dioxide extracts of coriander (Coriandrum sativum L.) fruits
  45. ↑ Volatile components of zinchoge flower (Daphne odora Thunb.).
  46. ↑ Characterization of some volatile constituents of carrots
  47. ↑ Essential-oil composition of Daucus carota ssp. major (Pastinocello Carrot) and nine different commercial varieties of Daucus carota ssp. sativus fruits.
  48. ↑ Changes in volatile compounds of carrots (Daucus carota L.) during refrigerated and frozen storage.
  49. ↑ Analysis of the Essential Oil of Eupatorium cannabinum by Combined Gas Chromatography-Mass Spectrometry Using Electron Impact and Negative Ion Chemical Ionization
  50. ↑ Qualitative analysis of the odoriferous fraction of oakmoss (Evernia prunastri)
  51. ↑ The scent of the reticulated giraffe (Giraffa camelopardalis reticulata)
  52. ↑ 52,0 52,1 Cell-destroying sesquiterpenoid from red tide of Gymnodinium nagasakiense
  53. ↑ Occurrence of N-methyl-N-formylhydrazones in fresh and processed false morel, Gyromitra esculenta
  54. ↑ Study on the composition of the volatile fraction of Hamamelis virginiana
  55. ↑ 55,0 55,1 Composition and antibacterial activity of the essential oils of Helichrysum rupestre and H. ambiguum growing in the Balearic Islands (Part III)
  56. ↑ Comparison of the most odor-active compounds in fresh and dried hop cones (Humulus lupulus L. variety spalter select) based on GC-olfactometry and odor dilution techniques
  57. ↑ Constituents of the Cold-Pressed Oil of Faustrime, A Trigeneric Hybrid ofMonocitrus australasicaxFortunellasp. xCitrus aurantifolia
  58. ↑ Composition of the Essential Oil ofMicromeria biflora
  59. ↑ Volatile Leaf Oils of Caribbean Myrtaceae. I. Three Varieties ofPimenta racemosa(Miller) J. Moore of the Dominican Republic and the Commercial Bay Oil
  60. ↑ Sesquiterpene glycosides and other terpene constituents from the flowers of Pittosporum tobira
  61. ↑ Sex pheromone in a marine polychaete: Determination of the chemical structure
  62. ↑ Volatile compounds ofPolygala senega L. var.latifolia Torrey et Gray roots
  63. ↑ 63,0 63,1 Components of almond hulls: possible navel orangeworm attractants and growth inhibitors
  64. ↑ Characterization of the Essential Oil ofSideritis dichotoma
  65. ↑ Chemical Composition ofTagetes minutaL. Oil from Himachal Pradesh (India)
  66. ↑ Composition of the Essential Oil ofThymus longicaulisC. Presl. var.subisophyllus(Borbas) Jalas from Turkey
  67. ↑ Essential Oils from Four Chemotypes ofThymus zygioidesGriseb. var.lycaonicus(Celak) Ronniger
  68. ↑ Volatiles of corn tassels: possible corn ear worm attractants
  69. ↑ Volatiles of corn kernels and husks: possible corn ear worm attractants
  70. ↑ Investigation of the essential oil of Vietnamese ginger
  71. ↑ Composition of the Oenanthe aquatica essential oil
  72. ↑ Essential oils from hairy root cultures and from fruits and roots of Pimpinella anisum
  73. ↑ Non‐Heptane Constituents of Digger Pine (Pinussabinana)
  74. ↑ 74,0 74,1 Homoditerpenes from the essential oil of Tanacetum annuum
  75. ↑ The Aroma of Cranberries. II. Vaccinium macrocarpon Ait.
  76. ↑ 76,0 76,1 Constituents of the Flower Oil ofAlpinia speciosaK. Schum. from Vietnam
  77. ↑ Constituents of Cannabis sativa L. XVII. A review of the natural constituents
  78. ↑ The Aroma of Cranberries. I. Vaccinium vitis-idaea L..
  79. ↑ Volatile components from mango (Mangifera indica L.) cultivars
  80. ↑ Maturity stage at harvest affects fruit ripening, quality and biosynthesis of aroma volatile compounds in ‘Kensington Pride’ mango
  81. ↑ Volatiles from rhizomes of Rhodiola rosea L.
  82. ↑ COMPOSITION AND ANTIMICROBIAL ACTIVITY OF CELERY (APIUM GRAVEOLENS) LEAF AND ROOT EXTRACTS OBTAINED WITH LIQUID CARBON DIOXIDE
  83. ↑ 83,0 83,1 Propagation Method and Distillation Apparatus Type Affect Essential Oil from Different Parts of Matricaria recutita L. Plants
  84. ↑ Chemical composition of essential oils of two submerged macrophytes,Ceratophyllum demersum L. andVallisneria spiralis L.
  85. ↑ Volatile composition of sweet basil essential oil (Ocimum basilicum L.) as affected by drying method
  86. ↑ Metabolite profiling of Camellia sinensis by automated sequential, multidimensional gas chromatography/mass spectrometry reveals strong monsoon effects on tea constituents
  87. ↑ Chemical composition and antioxidant activity of volatiles from Patrinia Villosa Juss obtained by optimized supercritical fluid extraction
  88. ↑ The Essential Oil of Scaligeria lazica Boiss.
  89. ↑ The Chemical Composition of Citrus Hystrix DC (Swangi)
  90. ↑ Composition of the Leaf and Root Oils of Eryngium foetidum L.
  91. ↑ Composition of the Essential Oils of Heracleum stevenii Manden.
  92. ↑ 92,0 92,1 92,2 92,3 Essential Oil of Eryngium L. Species from New South Wales (Australia)
  93. ↑ Composition of Secondary Metabolites in Various Parts of 'Seolhyang' Strawberry Plants
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