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2-bromo-3-(2-octyldodecyl)thiophene

2-bromo-3-(2-octyldodecyl)thiophene

Formula: C24H43BrS

SMILES: CCCCCCCCCCC(CCCCCCCC)CC1=C(Br)SC=C1

IUPAC: 2-bromo-3-(2-octyldodecyl)thiophene

InChI: InChI=1/C24H43BrS/c1-3-5-7-9-11-12-14-16-18-22(17-15-13-10-8-6-4-2)21-23-19-20-26-24(23)25/h19-20,22H,3-18,21H2,1-2H3

Composition: C (64.99%), H (9.77%), Br (18.01%), S (7.23%)

Molar Mass: 443.57

Atom Count: 69

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 442.226886
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey MQXOLNIXHNEXIV-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 122.35
Topological Polar Surface Area 0
Polarizability 48.41
Ring Count 1
Rotatable Bond Count 18

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Purity LeadTime Formula UnitPrice
98% <14 Days C24H43BrS Quote Only