Home Other Building Blocks 1-[1-(difluoromethyl)-1H-1,3-benzodiazol-2-yl]ethan-1-one

1-[1-(difluoromethyl)-1H-1,3-benzodiazol-2-yl]ethan-1-one

CAS No.:
877963-87-6
Catalog Number:
AG019PJX
Molecular Formula:
C10H8F2N2O
Molecular Weight:
210.1801
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Product Description
Catalog Number:
AG019PJX
Chemical Name:
1-[1-(difluoromethyl)-1H-1,3-benzodiazol-2-yl]ethan-1-one
CAS Number:
877963-87-6
Molecular Formula:
C10H8F2N2O
Molecular Weight:
210.1801
MDL Number:
MFCD07850222
IUPAC Name:
1-[1-(difluoromethyl)benzimidazol-2-yl]ethanone
InChI:
InChI=1S/C10H8F2N2O/c1-6(15)9-13-7-4-2-3-5-8(7)14(9)10(11)12/h2-5,10H,1H3
InChI Key:
WAXPXZUCEYGWHK-UHFFFAOYSA-N
SMILES:
CC(=O)c1nc2c(n1C(F)F)cccc2
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.06g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.184g/mol
Monoisotopic Mass:
210.06g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties