3-hydroxy-2,2,4-trimethylpentanenitrile

3-hydroxy-2,2,4-trimethylpentanenitrile

CAS: 59346-56-4

Formula: C8H15NO

SMILES: CC(C)C(O)C(C)(C)C#N

IUPAC: 3-hydroxy-2,2,4-trimethylpentanenitrile

InChI: InChI=1/C8H15NO/c1-6(2)7(10)8(3,4)5-9/h6-7,10H,1-4H3

Composition: C (68.04%), H (10.71%), N (9.92%), O (11.33%)

Molar Mass: 141.214

Atom Count: 25

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	141.115364107
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	YQUDZXMXULHYPN-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.51
Topological Polar Surface Area	44.02
Polarizability	15.92
Ring Count	0
Rotatable Bond Count	2

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Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	59346-56-4		Quote Only