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16703-39-2

16703-39-2 | 2-Butanone, 3-(4-chlorophenyl)-3-methyl-

CAS No: 16703-39-2 Catalog No: AG001X3L MDL No:

Product Description

Catalog Number:
AG001X3L
Chemical Name:
2-Butanone, 3-(4-chlorophenyl)-3-methyl-
CAS Number:
16703-39-2
Molecular Formula:
C11H13ClO
Molecular Weight:
196.6733
IUPAC Name:
3-(4-chlorophenyl)-3-methylbutan-2-one
InChI:
InChI=1S/C11H13ClO/c1-8(13)11(2,3)9-4-6-10(12)7-5-9/h4-7H,1-3H3
InChI Key:
BVYURCFIUPFFDK-UHFFFAOYSA-N
SMILES:
CC(=O)C(c1ccc(cc1)Cl)(C)C

Properties

Complexity:
190  
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:
3.1  

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