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4-pentyl-4'-propyl-[1,1'-bi(cyclohexane)]-4-carbonitrile

4-pentyl-4'-propyl-[1,1'-bi(cyclohexane)]-4-carbonitrile

Formula: C21H37N

SMILES: CCCCCC1(CCC(CC1)C1CCC(CCC)CC1)C#N

IUPAC: 4-pentyl-4'-propyl-[1,1'-bi(cyclohexane)]-4-carbonitrile

InChI: InChI=1S/C21H37N/c1-3-5-6-14-21(17-22)15-12-20(13-16-21)19-10-8-18(7-4-2)9-11-19/h18-20H,3-16H2,1-2H3

Composition: C (83.10%), H (12.29%), N (4.61%)

Molar Mass: 303.534

Atom Count: 59

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 303.292600195
Formal Charge 0
FSP3 0.95
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey FPWFNVGRAFGQQV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 95.18
Topological Polar Surface Area 23.79
Polarizability 37.84
Ring Count 2
Rotatable Bond Count 7

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