2-NITRODIBENZOTHIOPHENE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H7NO2S
Molecular Weight	229.254
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-NITRODIBENZOTHIOPHENE

Structure Search

SMILES

[O-][N+](=O)C1=CC2=C(SC3=C2C=CC=C3)C=C1

InChI

InChIKey=GXLYVLHWXVRVKI-UHFFFAOYSA-N

InChI=1S/C12H7NO2S/c14-13(15)8-5-6-12-10(7-8)9-3-1-2-4-11(9)16-12/h1-7H

HIDE SMILES / InChI

Molecular Formula	C12H7NO2S
Molecular Weight	229.254
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 21:58:19 GMT 2025` Edited by `admin` on `Mon Mar 31 21:58:19 GMT 2025`
Record UNII	EK8F3V9FW3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-NITRODIBENZOTHIOPHENE

Systematic Name

English

NSC-16062

Preferred Name

English

2-NITRODIBENZO(B,D)THIOPHENE

Common Name

English

DIBENZOTHIOPHENE, 2-NITRO-

Systematic Name

English

Code System Code Type Description

FDA UNII

EK8F3V9FW3

Created by admin on Mon Mar 31 21:58:19 GMT 2025 , Edited by admin on Mon Mar 31 21:58:19 GMT 2025

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NSC

16062

Created by admin on Mon Mar 31 21:58:19 GMT 2025 , Edited by admin on Mon Mar 31 21:58:19 GMT 2025

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PUBCHEM

95072

Created by admin on Mon Mar 31 21:58:19 GMT 2025 , Edited by admin on Mon Mar 31 21:58:19 GMT 2025

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EPA CompTox

DTXSID00216609

Created by admin on Mon Mar 31 21:58:19 GMT 2025 , Edited by admin on Mon Mar 31 21:58:19 GMT 2025

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CAS

6639-36-7

Created by admin on Mon Mar 31 21:58:19 GMT 2025 , Edited by admin on Mon Mar 31 21:58:19 GMT 2025

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