Home Halogens 3-chloro-1-(4-fluorophenyl)butan-1-one

3-chloro-1-(4-fluorophenyl)butan-1-one

CAS No.:
70336-24-2
Catalog Number:
AG01C3X8
Molecular Formula:
C10H10ClFO
Molecular Weight:
200.6372
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Product Description
Catalog Number:
AG01C3X8
Chemical Name:
3-chloro-1-(4-fluorophenyl)butan-1-one
CAS Number:
70336-24-2
Molecular Formula:
C10H10ClFO
Molecular Weight:
200.6372
MDL Number:
MFCD24477992
IUPAC Name:
3-chloro-1-(4-fluorophenyl)butan-1-one
InChI:
InChI=1S/C10H10ClFO/c1-7(11)6-10(13)8-2-4-9(12)5-3-8/h2-5,7H,6H2,1H3
InChI Key:
QITFTPLJIREAHJ-UHFFFAOYSA-N
SMILES:
CC(CC(=O)c1ccc(cc1)F)Cl
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.637g/mol
Monoisotopic Mass:
200.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties