4-Hydroxycyclohexanecarbonitrile - CAS 24056-34-6

Catalog:	BB018313
Product Name:	4-Hydroxycyclohexanecarbonitrile
CAS:	24056-34-6
Synonyms:	4-hydroxy-1-cyclohexanecarbonitrile; 4-hydroxycyclohexane-1-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	4-hydroxycyclohexane-1-carbonitrile
Description:	4-Hydroxycyclohexanecarbonitrile (CAS# 24056-34-6) is a useful research chemical.
Molecular Weight:	125.17
Molecular Formula:	C7H11NO
Canonical SMILES:	C1CC(CCC1C#N)O
InChI:	InChI=1S/C7H11NO/c8-5-6-1-3-7(9)4-2-6/h6-7,9H,1-4H2
InChI Key:	WXWQWXGBEHIOBL-UHFFFAOYSA-N
Boiling Point:	270 °C at 760 mmHg
Density:	1.05 g/cm³
Appearance:	Solid
MDL:	MFCD13688990
LogP:	1.06108

Publication Number	Title	Priority Date
TW-202100520-A	Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors	20190305
US-2021017156-A1	Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors	20190305
WO-2020180959-A1	Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors	20190305
WO-2020119819-A1	Benzamides of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof	20181214
TW-202039474-A	Benzamides of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof	20181214

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Complexity:	127
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	125.084063974
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	125.084063974
Rotatable Bond Count:	0
Topological Polar Surface Area:	44
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5