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Home > Fluorides > 845780-99-6
845780-99-6 | (3,4-difluorophenyl)(4-methoxyphenyl)methanone
CAS No: 845780-99-6 Catalog No: AG01EXPK MDL No:MFCD06201554
Product Description
Catalog Number:
AG01EXPK
Chemical Name:
(3,4-difluorophenyl)(4-methoxyphenyl)methanone
CAS Number:
845780-99-6
Molecular Formula:
C14H10F2O2
Molecular Weight:
248.2248
MDL Number:
MFCD06201554
IUPAC Name:
(3,4-difluorophenyl)-(4-methoxyphenyl)methanone
InChI:
InChI=1S/C14H10F2O2/c1-18-11-5-2-9(3-6-11)14(17)10-4-7-12(15)13(16)8-10/h2-8H,1H3
InChI Key:
ONOCBOBFQRIUIS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)c1ccc(c(c1)F)F
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.065g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.229g/mol
Monoisotopic Mass:
248.065g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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