(1'r,4'r)-4'-(4-methylphenyl)-[1,1'-bi(cyclohexane)]-4-one

(1'r,4'r)-4'-(4-methylphenyl)-[1,1'-bi(cyclohexane)]-4-one

CAS: 125962-80-3

Formula: C19H26O

SMILES: CC1=CC=C(C=C1)[C@H]1CC[C@@H](CC1)C1CCC(=O)CC1

IUPAC: (1'r,4'r)-4'-(4-methylphenyl)-[1,1'-bi(cyclohexane)]-4-one

InChI: InChI=1/C19H26O/c1-14-2-4-15(5-3-14)16-6-8-17(9-7-16)18-10-12-19(20)13-11-18/h2-5,16-18H,6-13H2,1H3/t16-,17-

Composition: C (84.39%), H (9.69%), O (5.92%)

Molar Mass: 270.416

Atom Count: 46

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	270.198365457
Formal Charge	0
FSP3	0.63
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	KPISRXVEAOLMIF-QAQDUYKDNA-N
Lipinski's Rule of Five
Molar Refractivity	83.63
Topological Polar Surface Area	17.07
Polarizability	32.76
Ring Count	3
Rotatable Bond Count	2

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