3-(4-HYDROXY-3-METHOXYPHENYL)PROPIONALDEHYDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H12O3
Molecular Weight	180.2005
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(4-HYDROXY-3-METHOXYPHENYL)PROPIONALDEHYDE

Structure Search

SMILES

COC1=CC(CCC=O)=CC=C1O

InChI

InChIKey=KIEATOGEYUWTSR-UHFFFAOYSA-N

InChI=1S/C10H12O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h4-7,12H,2-3H2,1H3

HIDE SMILES / InChI

Molecular Formula	C10H12O3
Molecular Weight	180.2005
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:05:11 GMT 2023` Edited by `admin` on `Fri Dec 15 18:05:11 GMT 2023`
Record UNII	L47JXE0XF2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(4-HYDROXY-3-METHOXYPHENYL)PROPIONALDEHYDE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID20868588

Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023

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PUBCHEM

529899

Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023

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FDA UNII

L47JXE0XF2

Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023

PRIMARY

ECHA (EC/EINECS)

279-524-9

Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023

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CAS

80638-48-8

Created by admin on Fri Dec 15 18:05:11 GMT 2023 , Edited by admin on Fri Dec 15 18:05:11 GMT 2023

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