icosane-1-thiol

icosane-1-thiol

CAS: 13373-97-2

Formula: C20H42S

SMILES: CCCCCCCCCCCCCCCCCCCCS

IUPAC: icosane-1-thiol

InChI: InChI=1S/C20H42S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h21H,2-20H2,1H3

Composition: C (76.35%), H (13.46%), S (10.19%)

Molar Mass: 314.62

Atom Count: 63

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	314.300722526
Formal Charge	0
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
InChIKey	YYHYWOPDNMFEAV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	101.78
Topological Polar Surface Area	0
Polarizability	40.72
Ring Count	0
Rotatable Bond Count	18

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