Name: Name:2-hydroxy-5,5-dimethylcyclohexane-1-carbonitrile, Mixture of diastereomers
Brand: Angene
SKU: AG01EMJQ
Rating: 90 (10 reviews)

2-hydroxy-5,5-dimethylcyclohexane-1-carbonitrile, Mixture of diastereomers

CAS No.:

2090214-52-9

Catalog Number:

AG01EMJQ

Molecular Formula:

C9H15NO

Molecular Weight:

153.2215

Catalog Number:

AG01EMJQ

Chemical Name:

2-hydroxy-5,5-dimethylcyclohexane-1-carbonitrile, Mixture of diastereomers

CAS Number:

2090214-52-9

Molecular Formula:

C9H15NO

Molecular Weight:

153.2215

MDL Number:

MFCD31668081

IUPAC Name:

2-hydroxy-5,5-dimethylcyclohexane-1-carbonitrile

InChI:

InChI=1S/C9H15NO/c1-9(2)4-3-8(11)7(5-9)6-10/h7-8,11H,3-5H2,1-2H3

InChI Key:

VIFFOBJJBZWVET-UHFFFAOYSA-N

SMILES:

OC1CCC(CC1C#N)(C)C

Complexity:

189

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

153.115g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

153.225g/mol

Monoisotopic Mass:

153.115g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9