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1239370-98-9 | Borate(1-), (5-bromo-2-thienyl)trifluoro-, potassium (1:1), (T-4)-
CAS No: 1239370-98-9 Catalog No: AG000L89 MDL No:MFCD17015269
Product Description
Catalog Number:
AG000L89
Chemical Name:
Borate(1-), (5-bromo-2-thienyl)trifluoro-, potassium (1:1), (T-4)-
CAS Number:
1239370-98-9
Molecular Formula:
C4H2BBrF3KS
Molecular Weight:
268.9322
MDL Number:
MFCD17015269
IUPAC Name:
potassium;(5-bromothiophen-2-yl)-trifluoroboranuide
InChI:
InChI=1S/C4H2BBrF3S.K/c6-4-2-1-3(10-4)5(7,8)9;/h1-2H;/q-1;+1
InChI Key:
LNJIZRITMDDEGQ-UHFFFAOYSA-N
SMILES:
F[B-](c1ccc(s1)Br)(F)F.[K+]
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.874g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.928g/mol
Monoisotopic Mass:
267.874g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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