CAFFEYL ALCOHOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H10O3
Molecular Weight	166.1739
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of CAFFEYL ALCOHOL

Structure Search

SMILES

OC\C=C\C1=CC(O)=C(O)C=C1

InChI

InChIKey=ZCKDCRKBURQZPT-OWOJBTEDSA-N

InChI=1S/C9H10O3/c10-5-1-2-7-3-4-8(11)9(12)6-7/h1-4,6,10-12H,5H2/b2-1+

HIDE SMILES / InChI

Molecular Formula	C9H10O3
Molecular Weight	166.1739
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 09:54:32 GMT 2025` Edited by `admin` on `Wed Apr 02 09:54:32 GMT 2025`
Record UNII	P5Y9E2Q5EQ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CAFFEYL ALCOHOL

Common Name

English

NSC-624003

Preferred Name

English

1,2-BENZENEDIOL, 4-(3-HYDROXY-1-PROPENYL)-

Systematic Name

English

1,2-BENZENEDIOL, 4-((1E)-3-HYDROXY-1-PROPEN-1-YL)-

Systematic Name

English

1,2-BENZENEDIOL, 4-(3-HYDROXY-1-PROPEN-1-YL)-

Systematic Name

English

3-(3,4-DIHYDROXYPHENYL)PROP-2-EN-1-OL

Systematic Name

English

2-PROPEN-1-OL, 3-(3,4-DIHYDROXYPHENYL)-

Systematic Name

English

Code System Code Type Description

CAS

272785-02-1

Created by admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025

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WIKIPEDIA

Caffeyl alcohol

Created by admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025

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EPA CompTox

DTXSID20326956

Created by admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025

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FDA UNII

P5Y9E2Q5EQ

Created by admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025

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CAS

3598-26-3

Created by admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

CHEBI

31334

Created by admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025

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PUBCHEM

5282096

Created by admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025

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NSC

624003

Created by admin on Wed Apr 02 09:54:32 GMT 2025 , Edited by admin on Wed Apr 02 09:54:32 GMT 2025

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