Azo-mustard

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H19Cl2N3O2
Molecular Weight	380.268
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of Azo-mustard

Structure Search

SMILES

CC1=CC(=CC=C1\N=N\C2=CC=CC=C2C(O)=O)N(CCCl)CCCl

InChI

InChIKey=JRQFCUCILBFUNR-QURGRASLSA-N

InChI=1S/C18H19Cl2N3O2/c1-13-12-14(23(10-8-19)11-9-20)6-7-16(13)21-22-17-5-3-2-4-15(17)18(24)25/h2-7,12H,8-11H2,1H3,(H,24,25)/b22-21+

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Azo-mustard

Common Name

English

2-[2-[4-[Bis(2-chloroethyl)amino]-2-methylphenyl]diazenyl]benzoic acid

Systematic Name

English

Benzoic acid, 2-[2-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]diazenyl]-

Systematic Name

English

Benzoic acid, 2-[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]azo]-

Common Name

English

Benzoic acid, o-[[4-[(2-chloroethyl)amino]-o-tolyl]azo]-

Common Name

English

2′-Carboxy-4-[bis(2-chloroethyl)amino]-2-methylazobenzene

Systematic Name

English

NSC-16498

Code

English

Code System Code Type Description

PUBCHEM

20191

Created by admin on Fri Dec 15 16:41:35 GMT 2023 , Edited by admin on Fri Dec 15 16:41:35 GMT 2023

PRIMARY

EPA CompTox

DTXSID601039000

Created by admin on Fri Dec 15 16:41:35 GMT 2023 , Edited by admin on Fri Dec 15 16:41:35 GMT 2023

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FDA UNII

NL9BFV3XRT

Created by admin on Fri Dec 15 16:41:35 GMT 2023 , Edited by admin on Fri Dec 15 16:41:35 GMT 2023

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NSC

16498

Created by admin on Fri Dec 15 16:41:35 GMT 2023 , Edited by admin on Fri Dec 15 16:41:35 GMT 2023

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CAS

4213-40-5

Created by admin on Fri Dec 15 16:41:35 GMT 2023 , Edited by admin on Fri Dec 15 16:41:35 GMT 2023

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SUBSTANCE RECORD


					NL9BFV3XRT