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30314-42-2

30314-42-2 | 1-Propanone, 1-(4-chlorophenyl)-2,2-dimethyl-

CAS No: 30314-42-2 Catalog No: AG002ZNY MDL No:MFCD03841177

Product Description

Catalog Number:
AG002ZNY
Chemical Name:
1-Propanone, 1-(4-chlorophenyl)-2,2-dimethyl-
CAS Number:
30314-42-2
Molecular Formula:
C11H13ClO
Molecular Weight:
196.6733
MDL Number:
MFCD03841177
IUPAC Name:
1-(4-chlorophenyl)-2,2-dimethylpropan-1-one
InChI:
InChI=1S/C11H13ClO/c1-11(2,3)10(13)8-4-6-9(12)7-5-8/h4-7H,1-3H3
InChI Key:
DKFLDXIDGFZMCL-UHFFFAOYSA-N
SMILES:
O=C(C(C)(C)C)c1ccc(cc1)Cl

Properties

Complexity:
185  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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