Home Other Building Blocks 1-(1-phenyl-1H-1,2,3-triazol-4-yl)ethan-1-one

1-(1-phenyl-1H-1,2,3-triazol-4-yl)ethan-1-one

CAS No.:
128979-27-1
Catalog Number:
AG019ZNW
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG019ZNW
Chemical Name:
1-(1-phenyl-1H-1,2,3-triazol-4-yl)ethan-1-one
CAS Number:
128979-27-1
MDL Number:
MFCD22375265
IUPAC Name:
1-(1-phenyltriazol-4-yl)ethanone
InChI:
InChI=1S/C10H9N3O/c1-8(14)10-7-13(12-11-10)9-5-3-2-4-6-9/h2-7H,1H3
InChI Key:
XGJNBFOAUGABHH-UHFFFAOYSA-N
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.075g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.202g/mol
Monoisotopic Mass:
187.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Synthesis and investigation of tuberculosis inhibition activities of some 1,2,3-triazole derivatives. European journal of medicinal chemistry 20030201
Properties