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191213-55-5 | 2,2'-Bithiophene, 5-bromo-3,3'-bis(methylthio)-
CAS No: 191213-55-5 Catalog No: AG002F3U MDL No:
Product Description
Catalog Number:
AG002F3U
Chemical Name:
2,2'-Bithiophene, 5-bromo-3,3'-bis(methylthio)-
CAS Number:
191213-55-5
Molecular Formula:
C10H9BrS4
Molecular Weight:
337.3425
IUPAC Name:
5-bromo-3-methylsulfanyl-2-(3-methylsulfanylthiophen-2-yl)thiophene
InChI:
InChI=1S/C10H9BrS4/c1-12-6-3-4-14-9(6)10-7(13-2)5-8(11)15-10/h3-5H,1-2H3
InChI Key:
DPVCNCBQRHKQDY-UHFFFAOYSA-N
SMILES:
CSc1ccsc1c1sc(cc1SC)Br
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.877g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.326g/mol
Monoisotopic Mass:
335.877g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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