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Details

Stereochemistry ACHIRAL
Molecular Formula C3H3N3O2
Molecular Weight 113.0748
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID

SMILES

OC(=O)C1=NNC=N1

InChI

InChIKey=LJVQHXICFCZRJN-UHFFFAOYSA-N
InChI=1S/C3H3N3O2/c7-3(8)2-4-1-5-6-2/h1H,(H,7,8)(H,4,5,6)

HIDE SMILES / InChI

Molecular Formula C3H3N3O2
Molecular Weight 113.0748
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Tue Mar 06 12:06:33 UTC 2018
Edited
by admin
on Tue Mar 06 12:06:33 UTC 2018
Record UNII
7MLK3JCX3W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID
Systematic Name English
RIBAVIRIN IMPURITY C [EP]
Common Name English
NSC-165527
Code English
S-TRIAZOLE-3-CARBOXYLIC ACID
Systematic Name English
NSC-202574
Code English
1,2,4-TRIAZOLE-3-CARBOXYLIC ACID
Systematic Name English
4H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID
Systematic Name English
1H-1,2,4-TRIAZOLE-5-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
4928-87-4
Created by admin on Tue Mar 06 12:06:33 UTC 2018 , Edited by admin on Tue Mar 06 12:06:33 UTC 2018
PRIMARY
PUBCHEM
295900
Created by admin on Tue Mar 06 12:06:33 UTC 2018 , Edited by admin on Tue Mar 06 12:06:33 UTC 2018
PRIMARY
CAS
4928-87-4
Created by admin on Tue Mar 06 12:06:33 UTC 2018 , Edited by admin on Tue Mar 06 12:06:33 UTC 2018
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
Related Record Type Details
PARENT -> IMPURITY