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101452-11-3 | 2,2'-Bithiophene, 5-methyl-5'-(2-phenylethenyl)-
CAS No: 101452-11-3 Catalog No: AG0004I0 MDL No:
Product Description
Catalog Number:
AG0004I0
Chemical Name:
2,2'-Bithiophene, 5-methyl-5'-(2-phenylethenyl)-
CAS Number:
101452-11-3
Molecular Formula:
C17H14S2
Molecular Weight:
282.4231
IUPAC Name:
2-methyl-5-[5-(2-phenylethenyl)thiophen-2-yl]thiophene
InChI:
InChI=1S/C17H14S2/c1-13-7-11-16(18-13)17-12-10-15(19-17)9-8-14-5-3-2-4-6-14/h2-12H,1H3
InChI Key:
ZHXLSTPQYRQBCS-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)c1ccc(s1)C=Cc1ccccc1
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.054g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.419g/mol
Monoisotopic Mass:
282.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.7
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