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144692-61-5 | 1,1'-Bibenzo[c]thiophene, 1,1',3,3'-tetrahydro-
CAS No: 144692-61-5 Catalog No: AG001K0U MDL No:
Product Description
Catalog Number:
AG001K0U
Chemical Name:
1,1'-Bibenzo[c]thiophene, 1,1',3,3'-tetrahydro-
CAS Number:
144692-61-5
Molecular Formula:
C16H14S2
Molecular Weight:
270.4124
IUPAC Name:
1-(1,3-dihydro-2-benzothiophen-1-yl)-1,3-dihydro-2-benzothiophene
InChI:
InChI=1S/C16H14S2/c1-3-7-13-11(5-1)9-17-15(13)16-14-8-4-2-6-12(14)10-18-16/h1-8,15-16H,9-10H2
InChI Key:
WOSGENINHFRKAM-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)C(SC2)C1SCc2c1cccc2
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.054g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.408g/mol
Monoisotopic Mass:
270.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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