phenoxyethanol

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Artiklit veel pole, kuid saad aidata seda luua.

keemiline ühend

Välised allikad

Freebase	/m/0f65n2^[1]
Reaxys registry number	1364011
ZVG number	20470
PubChem CID	31236^[2]^[3]
MeSH descriptor ID	C005398^[4]
UniChem compound ID	657158^[5]
UNII	HIE492ZZ3T^[6]^[3]
PDB ligand ID	268
CAS Registry Number	122-99-6^[6]
Cannabis Database ID	000516^[7]
InChI	InChI=1S/C8H10O2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2^[2]
DSSTox substance ID	DTXSID9021976^[8]^[3] DTXSID90873407^[3]
NSC number	1864
ChEMBL ID	CHEMBL1229846^[9]
InChIKey	QCDWFXQBSFUVSP-UHFFFAOYSA-N^[2]^[10]
DrugBank ID	11304^[3]
ChEBI ID	64275^[9]^[11] mapping relation type: täpne vaste
CosIng number	36522^[12]
SPLASH	splash10-0006-9100000000-f8c06faa8eb8d23a95c1 splash10-0006-9100000000-7b2a4d4d9b09c7b78741 splash10-0006-9100000000-9bb41b75d1ad646b88f0 splash10-000i-0900000000-9421e4830e44b3388570 splash10-0006-9000000000-f53c3891b4914dd833e8 splash10-0006-9200000000-b5db9ef1d198ca188c7c splash10-0006-9100000000-ab2d6abdcb42c8020070 splash10-0006-9000000000-480278f55ce8ffc42edb splash10-0006-9100000000-9c2de92b427cc8e30262
SureChEMBL ID	SCHEMBL15708^[13]^[3]
EC number	204-589-7^[6]
DSSTOX compound identifier	DTXCID401976
PDB structure ID	2RBR^[14]
ECHA Substance Infocard ID	100.004.173^[15]
AICS Chemical ID (BEING DELETED)	3472
KNApSAcK ID	C00055732^[13]^[3]
UMLS CUI	C0301042^[16] C0116467^[17]
NE.se ID	2-fenoxietanol
Human Metabolome Database ID	HMDB0041607^[13]^[3]
ChemSpider ID	13848467^[18]
NMRShiftDB structure ID	10006089^[3]
Microsoft Academic ID	2778550416
DrugCentral ID	3442^[5]
CAMEO Chemicals ID	17818
MassBank accession ID	MSBNK-Fac_Eng_Univ_Tokyo-JP002864 MSBNK-Fac_Eng_Univ_Tokyo-JP003299 MSBNK-Fac_Eng_Univ_Tokyo-JP006187 MSBNK-Fac_Eng_Univ_Tokyo-JP006188 MSBNK-Fac_Eng_Univ_Tokyo-JP010023 MSBNK-Fac_Eng_Univ_Tokyo-JP007660 MSBNK-Fac_Eng_Univ_Tokyo-JP005873 MSBNK-Fac_Eng_Univ_Tokyo-JP008295 MSBNK-Fac_Eng_Univ_Tokyo-JP008573
ICSC ID	0538
HCIS ID	3466
RxNorm ID	89552^[6]
Probes And Drugs ID	PD013834
HSDB ID	5595^[19]

üksikjuht nähtusest

type of chemical entity

mille alamklass

Glükooleetrid

keemiline struktuur

mass/kaal

138,068 aatommassiühik^[20]

chemical formula

C₈H₁₀O₂^[2]

canonical SMILES

C1=CC=C(C=C1)OCCO^[2]

density

1,102 gram per cubic centimetre^[21]

temperatuur: 22 Celsiuse skaala

phase of matter: vedelik

sulamistemperatuur

12±2 Celsiuse skaala^[21]^[22]

uncertainty corresponds to: expanded uncertainty

12±1 Celsiuse skaala^[23]

keemistemperatuur

246±3 Celsiuse skaala^[21]

rõhk: 1013 hectopascal

uncertainty corresponds to: expanded uncertainty

237 Celsiuse skaala^[23]

rõhk: 1013 hectopascal

kasutatud kriteerium: miinimum

surface tension

70,7 millinewton per metre^[23]

temperatuur: 19,9 Celsiuse skaala

vapor pressure

0,001 kilopascal^[24]

temperatuur: 25 Celsiuse skaala

0,021 hectopascal^[23]

temperatuur: 25 Celsiuse skaala

solubility

26 gram per kilogram^[25]

temperatuur: 20 Celsiuse skaala

solvent: vesi

28,6 gram per litre^[23]

temperatuur: 20,7 Celsiuse skaala

solvent: vesi

refractive index

1,534^[21]

temperatuur: 20 Celsiuse skaala

wavelength: 589 nanomeeter

flash point

121 Celsiuse skaala^[24]^[23]

määramismeetod: Pensky–Martens closed-cup test

autoignition temperature

475 Celsiuse skaala^[23]

rõhk: 999±2 hectopascal

safety classification and labelling

NFPA 704: Standard System for the Identification of the Hazards of Materials for Emergency Response^[26]

NFPA Health: 2

NFPA Special: väärtus puudub

NFPA Fire: 1

NFPA Instability: 0

active ingredient in

Octenisept

found in taxon

endiiviasigur (endiivia, lehtsigur)^[27]

harilik sibul^[28]

subjektil on roll

anesthetic^[29]

local anti-infective agent^[29]

Commonsi kategooria

Phenoxyethanol

Viited

↑ Freebase Data Dumps, 28. oktoober 2013
↑ ^2,0 ^2,1 ^2,2 ^2,3 ^2,4 PubChem, 20. november 2016, inglise keel, 31236, 2-PHENOXYETHANOL
↑ ^3,0 ^3,1 ^3,2 ^3,3 ^3,4 ^3,5 ^3,6 ^3,7 ^3,8 QCDWFXQBSFUVSP-UHFFFAOYSA-N, InChIKey
↑ Medical Subject Headings, 14. märts 2018, C005398
↑ ^5,0 ^5,1 UniChem
↑ ^6,0 ^6,1 ^6,2 ^6,3 Global Substance Registration System, 20. november 2016, inglise keel, phenoxyethanol, HIE492ZZ3T
↑ Cannabis Database
↑ Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
↑ ^9,0 ^9,1 ChEMBL, 20. november 2016, inglise keel, 2-PHENOXYETHANOL, CHEMBL1229846
↑ ChEBI release 2020-09-01
↑ International Chemical Identifier, InChI=1S/C8H10O2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2
↑ CosIng database, 28. detsember 2019, 36522, PHENOXYETHANOL, CAS no.: 122-99-6
↑ ^13,0 ^13,1 ^13,2 inferred from InChIKey
↑ Protein Data Bank, 19. oktoober 2016, inglise keel, 2RBR, 2RBR
↑ ECHA Substance Infocard database, 27. detsember 2018, 100.004.173, 2-phenoxyethanol, CAS no.: 122-99-6
↑ WikiUMLS: Aligning UMLS to Wikipedia via Cross-lingual Neural Ranking
↑ UMLS 2023, 25. mai 2023, inferred by common MeSH mappings on source and on Wikidata
↑ ChemSpider, 20. november 2016, inglise keel, 13848467, Phenoxyethanol
↑ Hazardous Substances Data Bank, 10. mai 2021, 28. oktoober 2019, 2-PHENOXYETHANOL, 5595
↑ PubChem, 19. oktoober 2016, inglise keel, 31236, 2-PHENOXYETHANOL
↑ ^21,0 ^21,1 ^21,2 ^21,3 CRC Handbook of Chemistry and Physics (97th edition), 3-446
↑ Jean-Claude Bradley Open Melting Point Dataset
↑ ^23,0 ^23,1 ^23,2 ^23,3 ^23,4 ^23,5 ^23,6 24. juuli 2018, Sigma-Aldrich, poola keel, https://www.sigmaaldrich.com/MSDS/MSDS/DisplayMSDSPage.do?country=PL&language=pl&productNumber=P1126&brand=ALDRICH&PageToGoToURL=http%3A%2F%2Fwww.sigmaaldrich.com%2Fcatalog%2Fproduct%2Faldrich%2Fp1126%3Flang%3Dpl, 2-Fenoksyetanol, 23. aprill 2018
↑ ^24,0 ^24,1 CRC Handbook of Chemistry and Physics (97th edition), 15-18, 16-29
↑ CRC Handbook of Chemistry and Physics (97th edition), 5-161
↑ 24. juuli 2018, Sigma-Aldrich, inglise keel, https://www.sigmaaldrich.com/MSDS/MSDS/DisplayMSDSPage.do?country=US&language=en&productNumber=P1126&brand=ALDRICH&PageToGoToURL=http%3A%2F%2Fwww.sigmaaldrich.com%2Fcatalog%2Fproduct%2Faldrich%2Fp1126%3Flang%3Dpl, 2-Phenoxyethanol, 24. aprill 2015
↑ Neutral volatiles from blended endive (Cichorium endivia, L.)
↑ Influence of Pickling Process on and Metabolome as Determined Mass Spectrometry-Based Metabolomics
↑ ^29,0 ^29,1 Medical Subject Headings, 15. märts 2018, C005398

[r972aa6d7-1] Freebase Data Dumps, 28. oktoober 2013

[r83aed286-2] 2,0 ^2,1 ^2,2 ^2,3 ^2,4 PubChem, 20. november 2016, inglise keel, 31236, 2-PHENOXYETHANOL

[r3c8f995e-3] 3,0 ^3,1 ^3,2 ^3,3 ^3,4 ^3,5 ^3,6 ^3,7 ^3,8 QCDWFXQBSFUVSP-UHFFFAOYSA-N, InChIKey

[r18fa1d65-4] Medical Subject Headings, 14. märts 2018, C005398

[rb4997d09-5] 5,0 ^5,1 UniChem

[r9ef3f010-6] 6,0 ^6,1 ^6,2 ^6,3 Global Substance Registration System, 20. november 2016, inglise keel, phenoxyethanol, HIE492ZZ3T

[r3f21ca14-7] Cannabis Database

[r76075370-8] Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

[r23cffe25-9] 9,0 ^9,1 ChEMBL, 20. november 2016, inglise keel, 2-PHENOXYETHANOL, CHEMBL1229846

[rdb8780da-10] ChEBI release 2020-09-01

[rebda955d-11] International Chemical Identifier, InChI=1S/C8H10O2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2

[r094d80e0-12] CosIng database, 28. detsember 2019, 36522, PHENOXYETHANOL, CAS no.: 122-99-6

[r2758fec3-13] 13,0 ^13,1 ^13,2 inferred from InChIKey

[r87e26f45-14] Protein Data Bank, 19. oktoober 2016, inglise keel, 2RBR, 2RBR

[ra00a2226-15] ECHA Substance Infocard database, 27. detsember 2018, 100.004.173, 2-phenoxyethanol, CAS no.: 122-99-6

[rd814517d-16] WikiUMLS: Aligning UMLS to Wikipedia via Cross-lingual Neural Ranking

[red18c18d-17] UMLS 2023, 25. mai 2023, inferred by common MeSH mappings on source and on Wikidata

[r2017178c-18] ChemSpider, 20. november 2016, inglise keel, 13848467, Phenoxyethanol

[rbbf2be53-19] Hazardous Substances Data Bank, 10. mai 2021, 28. oktoober 2019, 2-PHENOXYETHANOL, 5595

[r5602d215-20] PubChem, 19. oktoober 2016, inglise keel, 31236, 2-PHENOXYETHANOL

[r1c6fc73e-21] 21,0 ^21,1 ^21,2 ^21,3 CRC Handbook of Chemistry and Physics (97th edition), 3-446

[r2503c4a2-22] Jean-Claude Bradley Open Melting Point Dataset

[r9c2151eb-23] 23,0 ^23,1 ^23,2 ^23,3 ^23,4 ^23,5 ^23,6 24. juuli 2018, Sigma-Aldrich, poola keel, https://www.sigmaaldrich.com/MSDS/MSDS/DisplayMSDSPage.do?country=PL&language=pl&productNumber=P1126&brand=ALDRICH&PageToGoToURL=http%3A%2F%2Fwww.sigmaaldrich.com%2Fcatalog%2Fproduct%2Faldrich%2Fp1126%3Flang%3Dpl, 2-Fenoksyetanol, 23. aprill 2018

[r16ce3814-24] 24,0 ^24,1 CRC Handbook of Chemistry and Physics (97th edition), 15-18, 16-29

[ra749c30f-25] CRC Handbook of Chemistry and Physics (97th edition), 5-161

[r15378647-26] 24. juuli 2018, Sigma-Aldrich, inglise keel, https://www.sigmaaldrich.com/MSDS/MSDS/DisplayMSDSPage.do?country=US&language=en&productNumber=P1126&brand=ALDRICH&PageToGoToURL=http%3A%2F%2Fwww.sigmaaldrich.com%2Fcatalog%2Fproduct%2Faldrich%2Fp1126%3Flang%3Dpl, 2-Phenoxyethanol, 24. aprill 2015

[rb1f60003-27] Neutral volatiles from blended endive (Cichorium endivia, L.)

[rabadbae4-28] Influence of Pickling Process on and Metabolome as Determined Mass Spectrometry-Based Metabolomics

[r03a18fb4-29] 29,0 ^29,1 Medical Subject Headings, 15. märts 2018, C005398

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