Home Halogens 3-(4-bromophenyl)-2,2-dimethylcyclobutan-1-one

3-(4-bromophenyl)-2,2-dimethylcyclobutan-1-one

CAS No.:
1515467-00-1
Catalog Number:
AG01B1Y5
Molecular Formula:
C12H13BrO
Molecular Weight:
253.1350
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Product Description
Catalog Number:
AG01B1Y5
Chemical Name:
3-(4-bromophenyl)-2,2-dimethylcyclobutan-1-one
CAS Number:
1515467-00-1
Molecular Formula:
C12H13BrO
Molecular Weight:
253.1350
MDL Number:
MFCD24103080
IUPAC Name:
3-(4-bromophenyl)-2,2-dimethylcyclobutan-1-one
InChI:
InChI=1S/C12H13BrO/c1-12(2)10(7-11(12)14)8-3-5-9(13)6-4-8/h3-6,10H,7H2,1-2H3
InChI Key:
LNWBORBIJZQKRJ-UHFFFAOYSA-N
SMILES:
O=C1CC(C1(C)C)c1ccc(cc1)Br
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.139g/mol
Monoisotopic Mass:
252.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties