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Home > Fluorides > 181697-30-3
181697-30-3 | 1-(3,4-difluorophenyl)-2-phenylethan-1-one
CAS No: 181697-30-3 Catalog No: AG01EUF4 MDL No:
Product Description
Catalog Number:
AG01EUF4
Chemical Name:
1-(3,4-difluorophenyl)-2-phenylethan-1-one
CAS Number:
181697-30-3
Molecular Formula:
C14H10F2O
Molecular Weight:
232.2254
IUPAC Name:
1-(3,4-difluorophenyl)-2-phenylethanone
InChI:
InChI=1S/C14H10F2O/c15-12-7-6-11(9-13(12)16)14(17)8-10-4-2-1-3-5-10/h1-7,9H,8H2
InChI Key:
VPTXJBRYCJVKND-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)F)F)Cc1ccccc1
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.07g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.23g/mol
Monoisotopic Mass:
232.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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