Home Halogens 1-Propanone,2-chloro-1-(2,5-dimethylphenyl)-

1-Propanone,2-chloro-1-(2,5-dimethylphenyl)-

CAS No.:
88632-72-8
Catalog Number:
AG008ANL
Molecular Formula:
C11H13ClO
Molecular Weight:
196.6733
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Product Description
Catalog Number:
AG008ANL
Chemical Name:
1-Propanone,2-chloro-1-(2,5-dimethylphenyl)-
CAS Number:
88632-72-8
Molecular Formula:
C11H13ClO
Molecular Weight:
196.6733
MDL Number:
MFCD03988557
IUPAC Name:
2-chloro-1-(2,5-dimethylphenyl)propan-1-one
InChI:
InChI=1S/C11H13ClO/c1-7-4-5-8(2)10(6-7)11(13)9(3)12/h4-6,9H,1-3H3
InChI Key:
WJDFCWSMCKCWEU-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C(=O)C(Cl)C)C
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.065g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.674g/mol
Monoisotopic Mass:
196.065g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties