(3S)-3-hydroxy-2,2-dimethylcyclohexan-1-one

(3S)-3-hydroxy-2,2-dimethylcyclohexan-1-one

CAS: 87655-21-8

Formula: C8H14O2

SMILES: CC1(C)[C@@H](O)CCCC1=O

IUPAC: (3S)-3-hydroxy-2,2-dimethylcyclohexan-1-one

InChI: InChI=1S/C8H14O2/c1-8(2)6(9)4-3-5-7(8)10/h6,9H,3-5H2,1-2H3/t6-/m0/s1

Composition: C (67.57%), H (9.92%), O (22.50%)

Molar Mass: 142.198

Atom Count: 24

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	142.099379691
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	MAGFJLNBFXFQGX-LURJTMIESA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.84
Topological Polar Surface Area	37.3
Polarizability	15.43
Ring Count	1
Rotatable Bond Count	0

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