Home Halogens 1-chloro-1,1-difluoro-3-phenylpropan-2-one

1-chloro-1,1-difluoro-3-phenylpropan-2-one

CAS No.:
86340-72-9
Catalog Number:
AG01A3XC
Molecular Formula:
C9H7ClF2O
Molecular Weight:
204.6011
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Product Description
Catalog Number:
AG01A3XC
Chemical Name:
1-chloro-1,1-difluoro-3-phenylpropan-2-one
CAS Number:
86340-72-9
Molecular Formula:
C9H7ClF2O
Molecular Weight:
204.6011
MDL Number:
MFCD23144149
IUPAC Name:
1-chloro-1,1-difluoro-3-phenylpropan-2-one
InChI:
InChI=1S/C9H7ClF2O/c10-9(11,12)8(13)6-7-4-2-1-3-5-7/h1-5H,6H2
InChI Key:
GXZPJURDYSAYJK-UHFFFAOYSA-N
SMILES:
O=C(C(Cl)(F)F)Cc1ccccc1
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.601g/mol
Monoisotopic Mass:
204.015g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties