2,6-Diamino-4-nitrotoluene

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H9N3O2
Molecular Weight	167.1653
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,6-Diamino-4-nitrotoluene

Structure Search

SMILES

CC1=C(N)C=C(C=C1N)[N+]([O-])=O

InChI

InChIKey=SPOWAUDUGZVURQ-UHFFFAOYSA-N

InChI=1S/C7H9N3O2/c1-4-6(8)2-5(10(11)12)3-7(4)9/h2-3H,8-9H2,1H3

HIDE SMILES / InChI

Molecular Formula	C7H9N3O2
Molecular Weight	167.1653
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 `Sat Dec 16 09:05:11 GMT 2023` Edited by `admin` on `Sat Dec 16 09:05:11 GMT 2023`
Record UNII	CK8UX2A3X7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,6-Diamino-4-nitrotoluene

Systematic Name

English

2-Methyl-5-nitro-1,3-benzenediamine

Systematic Name

English

1,3-Benzenediamine, 2-methyl-5-nitro-

Systematic Name

English

4-Nitro-2,6-toluenediamine

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID20207973

Created by admin on Sat Dec 16 09:05:11 GMT 2023 , Edited by admin on Sat Dec 16 09:05:11 GMT 2023

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CAS

59229-75-3

Created by admin on Sat Dec 16 09:05:11 GMT 2023 , Edited by admin on Sat Dec 16 09:05:11 GMT 2023

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ECHA (EC/EINECS)

261-669-4

Created by admin on Sat Dec 16 09:05:11 GMT 2023 , Edited by admin on Sat Dec 16 09:05:11 GMT 2023

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FDA UNII

CK8UX2A3X7

Created by admin on Sat Dec 16 09:05:11 GMT 2023 , Edited by admin on Sat Dec 16 09:05:11 GMT 2023

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PUBCHEM

91671

Created by admin on Sat Dec 16 09:05:11 GMT 2023 , Edited by admin on Sat Dec 16 09:05:11 GMT 2023

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