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1314538-55-0 | Borate(1-), [[[(1,1-dimethylethoxy)carbonyl]amino]methyl]trifluoro-, potassium (1:1), (T-4)-
CAS No: 1314538-55-0 Catalog No: AG000W7K MDL No:MFCD19686142
Product Description
Catalog Number:
AG000W7K
Chemical Name:
Borate(1-), [[[(1,1-dimethylethoxy)carbonyl]amino]methyl]trifluoro-, potassium (1:1), (T-4)-
CAS Number:
1314538-55-0
Molecular Formula:
C6H12BF3KNO2
Molecular Weight:
237.0695
MDL Number:
MFCD19686142
IUPAC Name:
potassium;trifluoro-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]boranuide
InChI:
InChI=1S/C6H12BF3NO2.K/c1-6(2,3)13-5(12)11-4-7(8,9)10;/h4H2,1-3H3,(H,11,12);/q-1;+1
InChI Key:
WSOSBCPWIQUNLD-UHFFFAOYSA-N
SMILES:
F[B-](CNC(=O)OC(C)(C)C)(F)F.[K+]
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.055g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.071g/mol
Monoisotopic Mass:
237.055g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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