Home Halogens 1-(4-chlorophenyl)-4-methylpentan-1-one

1-(4-chlorophenyl)-4-methylpentan-1-one

CAS No.:
236418-01-2
Catalog Number:
AG019X6S
Molecular Formula:
C12H15ClO
Molecular Weight:
210.6999
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Product Description
Catalog Number:
AG019X6S
Chemical Name:
1-(4-chlorophenyl)-4-methylpentan-1-one
CAS Number:
236418-01-2
Molecular Formula:
C12H15ClO
Molecular Weight:
210.6999
MDL Number:
MFCD11105533
IUPAC Name:
1-(4-chlorophenyl)-4-methylpentan-1-one
InChI:
InChI=1S/C12H15ClO/c1-9(2)3-8-12(14)10-4-6-11(13)7-5-10/h4-7,9H,3,8H2,1-2H3
InChI Key:
MOMILWVUQFINQM-UHFFFAOYSA-N
SMILES:
CC(CCC(=O)c1ccc(cc1)Cl)C
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.081g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.701g/mol
Monoisotopic Mass:
210.081g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties