VANILLIN ACETATE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H10O4
Molecular Weight	194.184
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of VANILLIN ACETATE

Structure Search

SMILES

COC1=C(OC(C)=O)C=CC(C=O)=C1

InChI

InChIKey=PZSJOBKRSVRODF-UHFFFAOYSA-N

InChI=1S/C10H10O4/c1-7(12)14-9-4-3-8(6-11)5-10(9)13-2/h3-6H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C10H10O4
Molecular Weight	194.184
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 18:30:12 GMT 2023` Edited by `admin` on `Fri Dec 15 18:30:12 GMT 2023`
Record UNII	873YNA60FY
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

VANILLIN ACETATE

Systematic Name

English

BENZALDEHYDE, 4-(ACETYLOXY)-3-METHOXY-

Systematic Name

English

FEMA NO. 3108

Code

English

NSC-8499

Code

English

ACETYLVANILLIN

Systematic Name

English

O-ACETYLVANILLIN

Systematic Name

English

4-FORMYL-2-METHOXYPHENYL ACETATE

Systematic Name

English

4-O-ACETYLVANILLIN

Systematic Name

English

4-ACETOXY-3-METHOXYBENZALDEHYDE

Systematic Name

English

ACETOVANILLIN

Common Name

English

VANILLIN ACETATE [FHFI]

Common Name

English

NSC-25863

Code

English

VANILLYL ACETATE

Systematic Name

English

Classification Tree Code System Code

CFR

21 CFR 172.515

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

JECFA EVALUATION

VANILLIN ACETATE

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

Code System Code Type Description

PUBCHEM

61229

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

PRIMARY

NSC

25863

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

PRIMARY

FDA UNII

873YNA60FY

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

PRIMARY

SMS_ID

100000160869

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

PRIMARY

CHEBI

86956

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

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EVMPD

SUB173679

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

PRIMARY

CAS

881-68-5

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

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EPA CompTox

DTXSID4061256

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

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NSC

8499

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

PRIMARY

ECHA (EC/EINECS)

212-920-1

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

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JECFA MONOGRAPH

820

Created by admin on Fri Dec 15 18:30:12 GMT 2023 , Edited by admin on Fri Dec 15 18:30:12 GMT 2023

PRIMARY