Home Nitriles 4-hydroxy-1-methylcyclohexane-1-carbonitrile, cis

4-hydroxy-1-methylcyclohexane-1-carbonitrile, cis

CAS No.:
838835-51-1
Catalog Number:
AG01C2A3
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
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Product Description
Catalog Number:
AG01C2A3
Chemical Name:
4-hydroxy-1-methylcyclohexane-1-carbonitrile, cis
CAS Number:
838835-51-1
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
MDL Number:
MFCD28403036
IUPAC Name:
4-hydroxy-1-methylcyclohexane-1-carbonitrile
InChI:
InChI=1S/C8H13NO/c1-8(6-9)4-2-7(10)3-5-8/h7,10H,2-5H2,1H3
InChI Key:
FMNOPHVZUCKHFN-UHFFFAOYSA-N
SMILES:
O[C@@H]1CC[C@](CC1)(C)C#N
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.1g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
139.198g/mol
Monoisotopic Mass:
139.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties