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119889-85-9 | 2,2'-Bithiophene, 3-dodecyl-
CAS No: 119889-85-9 Catalog No: AG000PTC MDL No:
Product Description
Catalog Number:
AG000PTC
Chemical Name:
2,2'-Bithiophene, 3-dodecyl-
CAS Number:
119889-85-9
Molecular Formula:
C20H30S2
Molecular Weight:
334.5822
IUPAC Name:
3-dodecyl-2-thiophen-2-ylthiophene
InChI:
InChI=1S/C20H30S2/c1-2-3-4-5-6-7-8-9-10-11-13-18-15-17-22-20(18)19-14-12-16-21-19/h12,14-17H,2-11,13H2,1H3
InChI Key:
FZMTVAIUZKKCPP-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1ccsc1c1cccs1
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.179g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.58g/mol
Monoisotopic Mass:
334.179g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.2
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