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1979-36-8 | Ethanone, 1-(2,5-difluorophenyl)-
CAS No: 1979-36-8 Catalog No: AG002B5P MDL No:MFCD00009898
Product Description
Catalog Number:
AG002B5P
Chemical Name:
Ethanone, 1-(2,5-difluorophenyl)-
CAS Number:
1979-36-8
Molecular Formula:
C8H6F2O
Molecular Weight:
156.1294
MDL Number:
MFCD00009898
IUPAC Name:
1-(2,5-difluorophenyl)ethanone
InChI:
InChI=1S/C8H6F2O/c1-5(11)7-4-6(9)2-3-8(7)10/h2-4H,1H3
InChI Key:
HLAFIZUVVWJAKL-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)C(=O)C)F
EC Number:
217-837-4
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.039g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.132g/mol
Monoisotopic Mass:
156.039g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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