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138058-53-4 | 2,2'-Bithiophene, 3,3'-dioctyl-
CAS No: 138058-53-4 Catalog No: AG0017XE MDL No:
Product Description
Catalog Number:
AG0017XE
Chemical Name:
2,2'-Bithiophene, 3,3'-dioctyl-
CAS Number:
138058-53-4
Molecular Formula:
C24H38S2
Molecular Weight:
390.6885
IUPAC Name:
3-octyl-2-(3-octylthiophen-2-yl)thiophene
InChI:
InChI=1S/C24H38S2/c1-3-5-7-9-11-13-15-21-17-19-25-23(21)24-22(18-20-26-24)16-14-12-10-8-6-4-2/h17-20H,3-16H2,1-2H3
InChI Key:
NUKWQYRYPHRJSO-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1ccsc1c1sccc1CCCCCCCC
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.241g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
390.688g/mol
Monoisotopic Mass:
390.241g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
11.1
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