Home Nitriles 1-(4-broMophenyl)cyclohexanecarbonitrile

1-(4-broMophenyl)cyclohexanecarbonitrile

CAS No.:
626603-27-8
Catalog Number:
AG00EQAV
Molecular Formula:
C13H14BrN
Molecular Weight:
264.1610
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Product Description
Catalog Number:
AG00EQAV
Chemical Name:
1-(4-broMophenyl)cyclohexanecarbonitrile
CAS Number:
626603-27-8
Molecular Formula:
C13H14BrN
Molecular Weight:
264.1610
MDL Number:
MFCD11036805
IUPAC Name:
1-(4-bromophenyl)cyclohexane-1-carbonitrile
InChI:
InChI=1S/C13H14BrN/c14-12-6-4-11(5-7-12)13(10-15)8-2-1-3-9-13/h4-7H,1-3,8-9H2
InChI Key:
FQJKOWLQDAJQIW-UHFFFAOYSA-N
SMILES:
N#CC1(CCCCC1)c1ccc(cc1)Br
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.031g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.166g/mol
Monoisotopic Mass:
263.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties