5-NITROVANILLIN

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H7NO5
Molecular Weight	197.1449
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-NITROVANILLIN

Structure Search

SMILES

COC1=CC(C=O)=CC(=C1O)[N+]([O-])=O

InChI

InChIKey=ZEHYRTJBFMZHCY-UHFFFAOYSA-N

InChI=1S/C8H7NO5/c1-14-7-3-5(4-10)2-6(8(7)11)9(12)13/h2-4,11H,1H3

HIDE SMILES / InChI

Molecular Formula	C8H7NO5
Molecular Weight	197.1449
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 `Mon Mar 31 23:36:24 GMT 2025` Edited by `admin` on `Mon Mar 31 23:36:24 GMT 2025`
Record UNII	G6SQ47R9WB
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

5-NITROVANILLIN

Systematic Name

English

NSC-16932

Preferred Name

English

BENZALDEHYDE, 4-HYDROXY-3-METHOXY-5-NITRO-

Systematic Name

English

5-NITRO-4-HYDROXY-3-METHOXYBENZALDEHYDE

Systematic Name

English

3-METHOXY-4-HYDROXY-5-NITROBENZALDEHYDE

Systematic Name

English

4-HYDROXY-3-METHOXY-5-NITROBENZALDEHYDE

Systematic Name

English

4-HYDROXY-5-METHOXY-3-NITROBENZALDEHYDE

Systematic Name

English

NSC-35352

Code

English

3-NITRO-4-HYDROXY-5-METHOXYBENZALDEHYDE

Systematic Name

English

Code System Code Type Description

CAS

6635-20-7

Created by admin on Mon Mar 31 23:36:24 GMT 2025 , Edited by admin on Mon Mar 31 23:36:24 GMT 2025

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FDA UNII

G6SQ47R9WB

Created by admin on Mon Mar 31 23:36:24 GMT 2025 , Edited by admin on Mon Mar 31 23:36:24 GMT 2025

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EPA CompTox

DTXSID2075344

Created by admin on Mon Mar 31 23:36:24 GMT 2025 , Edited by admin on Mon Mar 31 23:36:24 GMT 2025

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ECHA (EC/EINECS)

229-633-2

Created by admin on Mon Mar 31 23:36:24 GMT 2025 , Edited by admin on Mon Mar 31 23:36:24 GMT 2025

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PUBCHEM

81134

Created by admin on Mon Mar 31 23:36:24 GMT 2025 , Edited by admin on Mon Mar 31 23:36:24 GMT 2025

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NSC

35352

Created by admin on Mon Mar 31 23:36:24 GMT 2025 , Edited by admin on Mon Mar 31 23:36:24 GMT 2025

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NSC

16932

Created by admin on Mon Mar 31 23:36:24 GMT 2025 , Edited by admin on Mon Mar 31 23:36:24 GMT 2025

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CHEBI

48385

Created by admin on Mon Mar 31 23:36:24 GMT 2025 , Edited by admin on Mon Mar 31 23:36:24 GMT 2025

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