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

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

CAS: 151772-66-6

Formula: C13H22O

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

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

InChI: InChI=1/C13H22O/c1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12/h10-12H,2-9H2,1H3/t10-,11-

Composition: C (80.35%), H (11.41%), O (8.23%)

Molar Mass: 194.318

Atom Count: 36

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 194.167065328
Formal Charge 0
FSP3 0.92
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey RHUNWKYRWMYYMP-XYPYZODXNA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.49
Topological Polar Surface Area 17.07
Polarizability 23.3
Ring Count 2
Rotatable Bond Count 1

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