Home Nitriles 3,3,5,5-tetramethylcyclohexane-1-carbonitrile

3,3,5,5-tetramethylcyclohexane-1-carbonitrile

CAS No.:
1418273-69-4
Catalog Number:
AG01B5G3
Molecular Formula:
C11H19N
Molecular Weight:
165.2753
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Product Description
Catalog Number:
AG01B5G3
Chemical Name:
3,3,5,5-tetramethylcyclohexane-1-carbonitrile
CAS Number:
1418273-69-4
Molecular Formula:
C11H19N
Molecular Weight:
165.2753
MDL Number:
MFCD26079774
IUPAC Name:
3,3,5,5-tetramethylcyclohexane-1-carbonitrile
InChI:
InChI=1S/C11H19N/c1-10(2)5-9(7-12)6-11(3,4)8-10/h9H,5-6,8H2,1-4H3
InChI Key:
MNVBITVAJIQOJN-UHFFFAOYSA-N
SMILES:
N#CC1CC(C)(C)CC(C1)(C)C
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.152g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.28g/mol
Monoisotopic Mass:
165.152g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties