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1023357-66-5 | Borate(1-), [3-(1,1-dimethylethoxy)-3-oxopropyl]trifluoro-, potassium (1:1), (T-4)-
CAS No: 1023357-66-5 Catalog No: AG00077E MDL No:MFCD09993465
Product Description
Catalog Number:
AG00077E
Chemical Name:
Borate(1-), [3-(1,1-dimethylethoxy)-3-oxopropyl]trifluoro-, potassium (1:1), (T-4)-
CAS Number:
1023357-66-5
Molecular Formula:
C7H13BF3KO2
Molecular Weight:
236.0814
MDL Number:
MFCD09993465
IUPAC Name:
potassium;trifluoro-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]boranuide
InChI:
InChI=1S/C7H13BF3O2.K/c1-7(2,3)13-6(12)4-5-8(9,10)11;/h4-5H2,1-3H3;/q-1;+1
InChI Key:
SCIFNXNSQDOFML-UHFFFAOYSA-N
SMILES:
F[B-](CCC(=O)OC(C)(C)C)(F)F.[K+]
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.06g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.083g/mol
Monoisotopic Mass:
236.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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