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1218908-71-4 | Borate(1-), (4-chloro-3-nitrophenyl)trifluoro-, potassium (1:1), (T-4)-
CAS No: 1218908-71-4 Catalog No: AG0016C8 MDL No:MFCD12026115
Product Description
Catalog Number:
AG0016C8
Chemical Name:
Borate(1-), (4-chloro-3-nitrophenyl)trifluoro-, potassium (1:1), (T-4)-
CAS Number:
1218908-71-4
Molecular Formula:
C6H3BClF3KNO2
Molecular Weight:
263.4510
MDL Number:
MFCD12026115
IUPAC Name:
potassium;(4-chloro-3-nitrophenyl)-trifluoroboranuide
InChI:
InChI=1S/C6H3BClF3NO2.K/c8-5-2-1-4(7(9,10)11)3-6(5)12(13)14;/h1-3H;/q-1;+1
InChI Key:
PAXRNCOHQNLNIO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Cl)[B-](F)(F)F.[K+]
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.953g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.449g/mol
Monoisotopic Mass:
262.953g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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