1-(4-Methoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one

HCID 13816005CAS 89082-07-5

Basic information

Standard SMILES
COc1ccc(C(=O)Cn2cncn2)cc1
InChIKey
VIEZOAOPEPPATJ-UHFFFAOYSA-N
Molecular formula
C11H11N3O2
Average molar mass
217.22 g/mol
Monoisotopic mass
217.08512659

Names & identifiers

Preferred name
1-(4-Methoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one
IUPAC
1-(4-methoxyphenyl)-2-(1,2,4-triazol-1-yl)ethanone

Names & synonyms

89082-07-51-(4-Methoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)ethanone1-(4-methoxyphenyl)-2-(1,2,4-triazol-1-yl)ethanoneSCHEMBL10559569DTXSID20550411VIEZOAOPEPPATJ-UHFFFAOYSA-N1-(4-Methoxyphenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-one1- (4-methoxyphenyl)-2-(1H-1,2,4-triazole-1-yl) ethanone1-(4-methoxyphenyl)-2-(1H-1,2,4-triazole-1-yl) ethanone

Database identifiers

CAS
89082-07-5
PubChem CID
13816005
DTXSID
DTXSID20550411
Nikkaji
J1.327.248D

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
57 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
16

Related reactions

3 records

Linked notes

Loading…