4-Benzyl-5-(2-chloro-phenyl)-4H-[1,2,4]triazole-3-thiol

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Catalog Number
ACM23282942
Product Name
4-Benzyl-5-(2-chloro-phenyl)-4H-[1,2,4]triazole-3-thiol
Structure
Structure
CAS
23282-94-2
Category
Heterocyclic Organic Compound
Synonyms
ZINC03270871, 23282-94-2
IUPAC Name
4-benzyl-5-(2-chlorophenyl)-1,2,4-triazole-3-thiolate
Molecular Weight
301.794
Molecular Formula
C15H12ClN3S
Canonical SMILES
C1=CC=C(C=C1)CN2C(=NNC2=S)C3=CC=CC=C3Cl
InChI Key
KDDNIZALMTWHOV-UHFFFAOYSA-M
Boiling Point
425.8ºC at 760mmHg
Flash Point
211.3ºC
Density
1.33g/cm³
Exact Mass
301.04400
H-Bond Acceptor
3
H-Bond Donor
0
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