2-NITRO-4-(PROPYLTHIO)ANILINE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H12N2O2S
Molecular Weight	212.269
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-NITRO-4-(PROPYLTHIO)ANILINE

Structure Search

SMILES

CCCSC1=CC=C(N)C(=C1)[N+]([O-])=O

InChI

InChIKey=LFZBJSIIHWNZAW-UHFFFAOYSA-N

InChI=1S/C9H12N2O2S/c1-2-5-14-7-3-4-8(10)9(6-7)11(12)13/h3-4,6H,2,5,10H2,1H3

HIDE SMILES / InChI

Molecular Formula	C9H12N2O2S
Molecular Weight	212.269
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 20:35:27 GMT 2025` Edited by `admin` on `Mon Mar 31 20:35:27 GMT 2025`
Record UNII	71H5MD73WZ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2-NITRO-4-(PROPYLTHIO)ANILINE

Systematic Name

English

(2-NITRO-4-(PROPYLTHIO)PHENYL)AMINE

Preferred Name

English

BENZENAMINE, 2-NITRO-4-(PROPYLTHIO)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80202782

Created by admin on Mon Mar 31 20:35:27 GMT 2025 , Edited by admin on Mon Mar 31 20:35:27 GMT 2025

PRIMARY

ECHA (EC/EINECS)

259-142-9

Created by admin on Mon Mar 31 20:35:27 GMT 2025 , Edited by admin on Mon Mar 31 20:35:27 GMT 2025

PRIMARY

PUBCHEM

3016876

Created by admin on Mon Mar 31 20:35:27 GMT 2025 , Edited by admin on Mon Mar 31 20:35:27 GMT 2025

PRIMARY

CAS

54393-89-4

Created by admin on Mon Mar 31 20:35:27 GMT 2025 , Edited by admin on Mon Mar 31 20:35:27 GMT 2025

PRIMARY

FDA UNII

71H5MD73WZ

Created by admin on Mon Mar 31 20:35:27 GMT 2025 , Edited by admin on Mon Mar 31 20:35:27 GMT 2025

PRIMARY