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23354-88-3 | Thiophene, 2,2'-(1,4-phenylene)bis[5-bromo-
CAS No: 23354-88-3 Catalog No: AG002MYF MDL No:
Product Description
Catalog Number:
AG002MYF
Chemical Name:
Thiophene, 2,2'-(1,4-phenylene)bis[5-bromo-
CAS Number:
23354-88-3
Molecular Formula:
C14H8Br2S2
Molecular Weight:
400.1513
IUPAC Name:
2-bromo-5-[4-(5-bromothiophen-2-yl)phenyl]thiophene
InChI:
InChI=1S/C14H8Br2S2/c15-13-7-5-11(17-13)9-1-2-10(4-3-9)12-6-8-14(16)18-12/h1-8H
InChI Key:
HOGHBJHNNCRXIZ-UHFFFAOYSA-N
SMILES:
Brc1ccc(s1)c1ccc(cc1)c1ccc(s1)Br
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.841g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
400.146g/mol
Monoisotopic Mass:
397.843g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
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