4-NITROBENZENETHIOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H5NO2S
Molecular Weight	155.174
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-NITROBENZENETHIOL

Structure Search

SMILES

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

InChI

InChIKey=AXBVSRMHOPMXBA-UHFFFAOYSA-N

InChI=1S/C6H5NO2S/c8-7(9)5-1-3-6(10)4-2-5/h1-4,10H

HIDE SMILES / InChI

Molecular Formula	C6H5NO2S
Molecular Weight	155.174
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 22:24:44 GMT 2025` Edited by `admin` on `Mon Mar 31 22:24:44 GMT 2025`
Record UNII	QL9H28763R
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-128182

Preferred Name

English

4-NITROBENZENETHIOL

Systematic Name

English

P-NITROTHIOPHENOL

Systematic Name

English

4-NITROTHIOPHENOLATE

Common Name

English

BENZENETHIOL, 4-NITRO-

Systematic Name

English

BENZENETHIOL, P-NITRO-

Systematic Name

English

Code System Code Type Description

NSC

128182

Created by admin on Mon Mar 31 22:24:44 GMT 2025 , Edited by admin on Mon Mar 31 22:24:44 GMT 2025

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PUBCHEM

15809

Created by admin on Mon Mar 31 22:24:44 GMT 2025 , Edited by admin on Mon Mar 31 22:24:44 GMT 2025

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ECHA (EC/EINECS)

217-436-4

Created by admin on Mon Mar 31 22:24:44 GMT 2025 , Edited by admin on Mon Mar 31 22:24:44 GMT 2025

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EPA CompTox

DTXSID1075145

Created by admin on Mon Mar 31 22:24:44 GMT 2025 , Edited by admin on Mon Mar 31 22:24:44 GMT 2025

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CAS

1849-36-1

Created by admin on Mon Mar 31 22:24:44 GMT 2025 , Edited by admin on Mon Mar 31 22:24:44 GMT 2025

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FDA UNII

QL9H28763R

Created by admin on Mon Mar 31 22:24:44 GMT 2025 , Edited by admin on Mon Mar 31 22:24:44 GMT 2025

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