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3-(2-octyldodecyl)thiophene

3-(2-octyldodecyl)thiophene

CAS: 1268060-76-9

Formula: C24H44S

SMILES: CCCCCCCCCCC(CCCCCCCC)CC1=CSC=C1

IUPAC: 3-(2-octyldodecyl)thiophene

InChI: InChI=1/C24H44S/c1-3-5-7-9-11-12-14-16-18-23(21-24-19-20-25-22-24)17-15-13-10-8-6-4-2/h19-20,22-23H,3-18,21H2,1-2H3

Composition: C (79.05%), H (12.16%), S (8.79%)

Molar Mass: 364.68

Atom Count: 69

Heavy Atom Count: 25

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 364.316372591
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey CRKVMRJSMBQYRV-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 115.57
Topological Polar Surface Area 0
Polarizability 45.8
Ring Count 1
Rotatable Bond Count 18

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