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119143-38-3

119143-38-3 | 2-Butanone, 1-bromo-1-(4-chlorophenyl)-3,3-dimethyl-

CAS No: 119143-38-3 Catalog No: AG000I9J MDL No:

Product Description

Catalog Number:
AG000I9J
Chemical Name:
2-Butanone, 1-bromo-1-(4-chlorophenyl)-3,3-dimethyl-
CAS Number:
119143-38-3
Molecular Formula:
C12H14BrClO
Molecular Weight:
289.5960
IUPAC Name:
1-bromo-1-(4-chlorophenyl)-3,3-dimethylbutan-2-one
InChI:
InChI=1S/C12H14BrClO/c1-12(2,3)11(15)10(13)8-4-6-9(14)7-5-8/h4-7,10H,1-3H3
InChI Key:
YCUUWJAWXOIAEH-UHFFFAOYSA-N
SMILES:
BrC(C(=O)C(C)(C)C)c1ccc(cc1)Cl

Properties

Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.992g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.597g/mol
Monoisotopic Mass:
287.992g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  

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