3,5-Dinitroanisole

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H6N2O5
Molecular Weight	198.1329
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-Dinitroanisole

Structure Search

SMILES

COC1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=OTMLGCBMOMNGCV-UHFFFAOYSA-N

InChI=1S/C7H6N2O5/c1-14-7-3-5(8(10)11)2-6(4-7)9(12)13/h2-4H,1H3

HIDE SMILES / InChI

Molecular Formula	C7H6N2O5
Molecular Weight	198.1329
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 `Tue Apr 01 19:49:34 GMT 2025` Edited by `admin` on `Tue Apr 01 19:49:34 GMT 2025`
Record UNII	3LFZ5SGR6C
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3,5-Dinitroanisole

Systematic Name

English

NSC-3331

Preferred Name

English

Anisole, 3,5-dinitro-

Systematic Name

English

Benzene, 1-methoxy-3,5-dinitro-

Systematic Name

English

AI3-19029

Code

English

Code System Code Type Description

NSC

3331

Created by admin on Tue Apr 01 19:49:34 GMT 2025 , Edited by admin on Tue Apr 01 19:49:34 GMT 2025

PRIMARY

CAS

5327-44-6

Created by admin on Tue Apr 01 19:49:34 GMT 2025 , Edited by admin on Tue Apr 01 19:49:34 GMT 2025

PRIMARY

FDA UNII

3LFZ5SGR6C

Created by admin on Tue Apr 01 19:49:34 GMT 2025 , Edited by admin on Tue Apr 01 19:49:34 GMT 2025

PRIMARY

EPA CompTox

DTXSID1063778

Created by admin on Tue Apr 01 19:49:34 GMT 2025 , Edited by admin on Tue Apr 01 19:49:34 GMT 2025

PRIMARY

PUBCHEM

79231

Created by admin on Tue Apr 01 19:49:34 GMT 2025 , Edited by admin on Tue Apr 01 19:49:34 GMT 2025

PRIMARY