2-[bis(4-chlorophenyl)methyl]-2H-1,2,3-triazole

HCID 20034902

Notes Reactions

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Basic information

Standard SMILES: Clc1ccc(C(c2ccc(Cl)cc2)n2nccn2)cc1
InChIKey: YZCGKHJOYXRHSB-UHFFFAOYSA-N
Molecular formula: C15H11Cl2N3
Average molar mass: 304.2 g/mol

Names & identifiers

Preferred name: 2-[bis(4-chlorophenyl)methyl]-2H-1,2,3-triazole
IUPAC: 2-[bis(4-chlorophenyl)methyl]triazole

Names & synonyms

CHEMBL3354362-[bis(4-chlorophenyl)methyl]-2H-1,2,3-triazoleSCHEMBL10481297YZCGKHJOYXRHSB-UHFFFAOYSA-NBDBM500147902-[Bis-(4-chloro-phenyl)-methyl]-2H-[1,2,3]triazole

Database identifiers

PubChem CID: 20034902
ChEMBL: CHEMBL335436
Nikkaji: J272.152J

Properties

Computed structural properties

XLogP: 4.8
Topological polar surface area: 30.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 20
Formal charge: 0
Complexity: 271

Related reactions

2 records

New reaction record

HRID 231214As productuspto-grants-1989_07

HRID 2292088As productuspto-grants-1989_01

Compound notes

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