Home Halogens 2-Cyclohexen-1-one, 3-(4-chlorophenyl)-

2-Cyclohexen-1-one, 3-(4-chlorophenyl)-

CAS No.:
91398-51-5
Catalog Number:
AG006BFP
Molecular Formula:
C12H11ClO
Molecular Weight:
206.6681
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Product Description
Catalog Number:
AG006BFP
Chemical Name:
2-Cyclohexen-1-one, 3-(4-chlorophenyl)-
CAS Number:
91398-51-5
Molecular Formula:
C12H11ClO
Molecular Weight:
206.6681
MDL Number:
MFCD21141638
IUPAC Name:
3-(4-chlorophenyl)cyclohex-2-en-1-one
InChI:
InChI=1S/C12H11ClO/c13-11-6-4-9(5-7-11)10-2-1-3-12(14)8-10/h4-8H,1-3H2
InChI Key:
NHRHRYOUFLEDMW-UHFFFAOYSA-N
SMILES:
O=C1CCCC(=C1)c1ccc(cc1)Cl
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.05g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.669g/mol
Monoisotopic Mass:
206.05g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties