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3,4-dihexylthiophene

3,4-dihexylthiophene

CAS: 122107-04-4

Formula: C16H28S

SMILES: CCCCCCC1=CSC=C1CCCCCC

IUPAC: 3,4-dihexylthiophene

InChI: InChI=1S/C16H28S/c1-3-5-7-9-11-15-13-17-14-16(15)12-10-8-6-4-2/h13-14H,3-12H2,1-2H3

Composition: C (76.12%), H (11.18%), S (12.70%)

Molar Mass: 252.46

Atom Count: 45

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 252.191172076
Formal Charge 0
FSP3 0.75
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey YIRIIAIZQBBXHL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 79.26
Topological Polar Surface Area 0
Polarizability 30.94
Ring Count 1
Rotatable Bond Count 10

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