Home Other Building Blocks 1-[1-(4-fluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]ethan-1-one

1-[1-(4-fluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]ethan-1-one

CAS No.:
1017471-25-8
Catalog Number:
AG019WFH
Molecular Formula:
C11H10FN3O
Molecular Weight:
219.2150
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019WFH
Chemical Name:
1-[1-(4-fluorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]ethan-1-one
CAS Number:
1017471-25-8
Molecular Formula:
C11H10FN3O
Molecular Weight:
219.2150
MDL Number:
MFCD10003315
IUPAC Name:
1-[1-(4-fluorophenyl)-5-methyltriazol-4-yl]ethanone
InChI:
InChI=1S/C11H10FN3O/c1-7-11(8(2)16)13-14-15(7)10-5-3-9(12)4-6-10/h3-6H,1-2H3
InChI Key:
KOGFLGOVBKEDMF-UHFFFAOYSA-N
SMILES:
CC(=O)c1nnn(c1C)c1ccc(cc1)F
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.081g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.219g/mol
Monoisotopic Mass:
219.081g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties