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151324-66-2 | 2,2':5',2''-Terthiophene, 3',4'-dihexyl-
CAS No: 151324-66-2 Catalog No: AG001NA8 MDL No:
Product Description
Catalog Number:
AG001NA8
Chemical Name:
2,2':5',2''-Terthiophene, 3',4'-dihexyl-
CAS Number:
151324-66-2
Molecular Formula:
C24H32S3
Molecular Weight:
416.7059
IUPAC Name:
3,4-dihexyl-2,5-dithiophen-2-ylthiophene
InChI:
InChI=1S/C24H32S3/c1-3-5-7-9-13-19-20(14-10-8-6-4-2)24(22-16-12-18-26-22)27-23(19)21-15-11-17-25-21/h11-12,15-18H,3-10,13-14H2,1-2H3
InChI Key:
SGUWUYAMHMJAOY-UHFFFAOYSA-N
SMILES:
CCCCCCc1c(sc(c1CCCCCC)c1cccs1)c1cccs1
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.167g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
416.7g/mol
Monoisotopic Mass:
416.167g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.3
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