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1094338-36-9 | 2,5-Difluorophenyl cyclopropyl ketone
CAS No: 1094338-36-9 Catalog No: AG01FCVG MDL No:
Product Description
Catalog Number:
AG01FCVG
Chemical Name:
2,5-Difluorophenyl cyclopropyl ketone
CAS Number:
1094338-36-9
Molecular Formula:
C10H8F2O
Molecular Weight:
182.1667
IUPAC Name:
cyclopropyl-(2,5-difluorophenyl)methanone
InChI:
InChI=1S/C10H8F2O/c11-7-3-4-9(12)8(5-7)10(13)6-1-2-6/h3-6H,1-2H2
InChI Key:
IAZYMFGPONAALF-UHFFFAOYSA-N
SMILES:
O=C(c1cc(F)ccc1F)C1CC1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.054g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.17g/mol
Monoisotopic Mass:
182.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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