Sodium 1H-1,2,4-triazolate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C2H2N3.Na
Molecular Weight	91.0471
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

[Na+].[N-]1C=NC=N1

InChI

InChIKey=NVMNEWNGLGACBB-UHFFFAOYSA-N

InChI=1S/C2H2N3.Na/c1-3-2-5-4-1;/h1-2H;/q-1;+1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count	MOL RATIO 1 MOL RATIO (average)

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

Molecular Formula	C2H3N3
Molecular Weight	69.0653
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Approval Year

PubMed

Show entries

Title	Date	PubMed
A new class of nonsteroidal aromatase inhibitors: design and synthesis of chromone and xanthone derivatives and inhibition of the P450 enzymes aromatase and 17 alpha-hydroxylase/C17,20-lyase.	2001 Mar 1	11262078
An alternative route for Carboni-Lindsey reaction: N,N cycloaddition of an alkene to s-tetrazine.	2001 May 31	11405696
Synthesis of 3-alkyl(aryl)-4-alkylidenamino-4,5-dihydro-1H-1,2,4-triazol-5-ones and 3-alkyl-4-alkylamino-4,5-dihydro-1H-1,2,4-triazol-5-ones as antitumor agents.	2002 Dec	12413828
A spin transition molecular material with a wide bistability domain.	2002 Nov 4	12489532
The susceptibility of certain microbial strains to fused 1,2,4-triazole derivatives.	2004	16146058

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Substance Class	Chemical
Record UNII	X90002Y44E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Sodium 1H-1,2,4-triazolate

Systematic Name

English

J321.870H

Preferred Name

English

SODIUM 1H-1,2,4-TRIAZOLIDE

Systematic Name

English

1H-1,2,4-TRIAZOLE, SODIUM SALT

Systematic Name

English

1H-1,2,4-TRIAZOLE, SODIUM SALT (1:1)

Systematic Name

English

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Code System

Code

Type

Description

SMS_ID

300000053547

PRIMARY

ECHA (EC/EINECS)

255-280-9

PRIMARY

PUBCHEM

4649906

PRIMARY

FDA UNII

X90002Y44E

PRIMARY

CAS

41253-21-8

PRIMARY

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Related Record

Type

Details


					10MS0Y1RDI

1H-1,2,4-Triazole

PARENT -> SALT/SOLVATE

Amount:

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SMILES

InChI

Approval Year

PubMed

Patents