Home Nitriles 2-cyclohexyl-2-hydroxyacetonitrile

2-cyclohexyl-2-hydroxyacetonitrile

CAS No.:
4354-47-6
Catalog Number:
AG01BCRX
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
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Product Description
Catalog Number:
AG01BCRX
Chemical Name:
2-cyclohexyl-2-hydroxyacetonitrile
CAS Number:
4354-47-6
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
MDL Number:
MFCD12169363
IUPAC Name:
2-cyclohexyl-2-hydroxyacetonitrile
InChI:
InChI=1S/C8H13NO/c9-6-8(10)7-4-2-1-3-5-7/h7-8,10H,1-5H2
InChI Key:
JLNKJTJSIQKWEU-UHFFFAOYSA-N
SMILES:
OC(C1CCCCC1)C#N
Properties
Complexity:
141  
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:
1  
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties