Home Halogens Benzenepropanenitrile, 3-bromo-a,a-dimethyl-

Benzenepropanenitrile, 3-bromo-a,a-dimethyl-

CAS No.:
118255-97-3
Catalog Number:
AG01ANF6
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01ANF6
Chemical Name:
Benzenepropanenitrile, 3-bromo-a,a-dimethyl-
CAS Number:
118255-97-3
MDL Number:
MFCD21196971
IUPAC Name:
3-(3-bromophenyl)-2,2-dimethylpropanenitrile
InChI:
InChI=1S/C11H12BrN/c1-11(2,8-13)7-9-4-3-5-10(12)6-9/h3-6H,7H2,1-2H3
InChI Key:
CXDWYUIJXIRXKO-UHFFFAOYSA-N
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.128g/mol
Monoisotopic Mass:
237.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties