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5-(5-hexylthiophen-2-yl)-2,2'-bithiophene

5-(5-hexylthiophen-2-yl)-2,2'-bithiophene

CAS: 151271-42-0

Formula: C18H20S3

SMILES: CCCCCCC1=CC=C(S1)C1=CC=C(S1)C1=CC=CS1

IUPAC: 5-(5-hexylthiophen-2-yl)-2,2'-bithiophene

InChI: InChI=1S/C18H20S3/c1-2-3-4-5-7-14-9-10-17(20-14)18-12-11-16(21-18)15-8-6-13-19-15/h6,8-13H,2-5,7H2,1H3

Composition: C (65.01%), H (6.06%), S (28.92%)

Molar Mass: 332.54

Atom Count: 41

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 332.072714166
Formal Charge 0
FSP3 0.33
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey LBMUANVIIFUZKC-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 94.77
Topological Polar Surface Area 0
Polarizability 39.23
Ring Count 3
Rotatable Bond Count 7

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97% <5 Days 151271-42-0 $45.40-$66.83$45.40$66.83
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