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138537-85-6 | 2,2':5',2'':5'',2''':5''',2''''-Quinquethiophene, 5,5''''-diethyl-
CAS No: 138537-85-6 Catalog No: AG0019EW MDL No:
Product Description
Catalog Number:
AG0019EW
Chemical Name:
2,2':5',2'':5'',2''':5''',2''''-Quinquethiophene, 5,5''''-diethyl-
CAS Number:
138537-85-6
Molecular Formula:
C24H20S5
Molecular Weight:
468.7406
IUPAC Name:
2,5-bis[5-(5-ethylthiophen-2-yl)thiophen-2-yl]thiophene
InChI:
InChI=1S/C24H20S5/c1-3-15-5-7-17(25-15)19-9-11-21(27-19)23-13-14-24(29-23)22-12-10-20(28-22)18-8-6-16(4-2)26-18/h5-14H,3-4H2,1-2H3
InChI Key:
BUEZPQYRBLEAKK-UHFFFAOYSA-N
SMILES:
CCc1ccc(s1)c1ccc(s1)c1ccc(s1)c1ccc(s1)c1ccc(s1)CC
Properties
Complexity:
495
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
468.017g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
468.724g/mol
Monoisotopic Mass:
468.017g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.8
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