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Details

Stereochemistry ACHIRAL
Molecular Formula C4H6ClN3O
Molecular Weight 147.563
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(Chloromethyl)-2,4-dihydro-4-methyl-3H-1,2,4-triazol-3-one

SMILES

CN1C(=O)NN=C1CCl

InChI

InChIKey=FFJXSRWDORQRPQ-UHFFFAOYSA-N
InChI=1S/C4H6ClN3O/c1-8-3(2-5)6-7-4(8)9/h2H2,1H3,(H,7,9)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
5-(Chloromethyl)-2,4-dihydro-4-methyl-3H-1,2,4-triazol-3-one
Systematic Name English
3H-1,2,4-Triazol-3-one, 5-(chloromethyl)-2,4-dihydro-4-methyl-
Preferred Name English
5-(Chloromethyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Systematic Name English
Code System Code Type Description
FDA UNII
WNU8MQJ2YG
Created by admin on Wed Apr 02 19:34:08 GMT 2025 , Edited by admin on Wed Apr 02 19:34:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID801185091
Created by admin on Wed Apr 02 19:34:08 GMT 2025 , Edited by admin on Wed Apr 02 19:34:08 GMT 2025
PRIMARY
PUBCHEM
58460043
Created by admin on Wed Apr 02 19:34:08 GMT 2025 , Edited by admin on Wed Apr 02 19:34:08 GMT 2025
PRIMARY
CAS
1338226-21-3
Created by admin on Wed Apr 02 19:34:08 GMT 2025 , Edited by admin on Wed Apr 02 19:34:08 GMT 2025
PRIMARY
NIH
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