4,4'-METHYLENEBIS(2-NITROANILINE)

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H12N4O4
Molecular Weight	288.2588
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,4'-METHYLENEBIS(2-NITROANILINE)

Structure Search

SMILES

NC1=CC=C(CC2=CC(=C(N)C=C2)[N+]([O-])=O)C=C1[N+]([O-])=O

InChI

InChIKey=WJLPZRZKWVPCMN-UHFFFAOYSA-N

InChI=1S/C13H12N4O4/c14-10-3-1-8(6-12(10)16(18)19)5-9-2-4-11(15)13(7-9)17(20)21/h1-4,6-7H,5,14-15H2

HIDE SMILES / InChI

Molecular Formula	C13H12N4O4
Molecular Weight	288.2588
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 17:36:54 GMT 2025` Edited by `admin` on `Tue Apr 01 17:36:54 GMT 2025`
Record UNII	LV43SY8L8E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-525981

Preferred Name

English

4,4'-METHYLENEBIS(2-NITROANILINE)

Systematic Name

English

BENZENAMINE, 4,4'-METHYLENEBIS(2-NITRO-

Systematic Name

English

4,4'-DIAMINO-3,3'-DINITRODIPHENYLMETHANE

Systematic Name

English

3,3'-DINITRO-4,4'-DIAMINODIPHENYLMETHANE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID70169895

Created by admin on Tue Apr 01 17:36:54 GMT 2025 , Edited by admin on Tue Apr 01 17:36:54 GMT 2025

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PUBCHEM

87127

Created by admin on Tue Apr 01 17:36:54 GMT 2025 , Edited by admin on Tue Apr 01 17:36:54 GMT 2025

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CAS

17474-44-1

Created by admin on Tue Apr 01 17:36:54 GMT 2025 , Edited by admin on Tue Apr 01 17:36:54 GMT 2025

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NSC

525981

Created by admin on Tue Apr 01 17:36:54 GMT 2025 , Edited by admin on Tue Apr 01 17:36:54 GMT 2025

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FDA UNII

LV43SY8L8E

Created by admin on Tue Apr 01 17:36:54 GMT 2025 , Edited by admin on Tue Apr 01 17:36:54 GMT 2025

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ECHA (EC/EINECS)

241-489-2

Created by admin on Tue Apr 01 17:36:54 GMT 2025 , Edited by admin on Tue Apr 01 17:36:54 GMT 2025

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