Sodium 1-methyl-4-nitro-1H-imidazol-5-olate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C4H4N3O3.Na
Molecular Weight	165.0826
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Sodium 1-methyl-4-nitro-1H-imidazol-5-olate

Structure Search

SMILES

[Na+].CN1C=NC(=C1[O-])[N+]([O-])=O

InChI

InChIKey=VKDKQRVWAYCZEM-UHFFFAOYSA-M

InChI=1S/C4H5N3O3.Na/c1-6-2-5-3(4(6)8)7(9)10;/h2,8H,1H3;/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula	C4H4N3O3
Molecular Weight	142.0929
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
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 20:22:32 GMT 2023` Edited by `admin` on `Sat Dec 16 20:22:32 GMT 2023`
Record UNII	4XXR6FT8ZA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Sodium 1-methyl-4-nitro-1H-imidazol-5-olate

Systematic Name

English

Azathioprine EP Impurity E Sodium Salt

Common Name

English

1H-Imidazol-5-ol, 1-methyl-4-nitro-, sodium salt

Common Name

English

5-Hydroxy-1-methyl-4-nitroimidazole Sodium Salt

Systematic Name

English

Code System Code Type Description

FDA UNII

4XXR6FT8ZA

Created by admin on Sat Dec 16 20:22:33 GMT 2023 , Edited by admin on Sat Dec 16 20:22:33 GMT 2023

PRIMARY

PUBCHEM

139025327

Created by admin on Sat Dec 16 20:22:33 GMT 2023 , Edited by admin on Sat Dec 16 20:22:33 GMT 2023

PRIMARY

CAS

35681-68-6

Created by admin on Sat Dec 16 20:22:33 GMT 2023 , Edited by admin on Sat Dec 16 20:22:33 GMT 2023

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Related Record Type Details


					762R038B91

1-METHYL-4-NITRO-5-HYDROXYIMIDAZOLE

PARENT -> SALT/SOLVATE

Amount: