Home Aminos potassium trifluoro(3-((4-fluorophenyl)amino)-3-oxopropyl)borate

potassium trifluoro(3-((4-fluorophenyl)amino)-3-oxopropyl)borate

CAS No.:
1705578-24-0
Catalog Number:
AG00ARSS
Molecular Formula:
C9H9BF4KNO
Molecular Weight:
273.0768
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Product Description
Catalog Number:
AG00ARSS
Chemical Name:
potassium trifluoro(3-((4-fluorophenyl)amino)-3-oxopropyl)borate
CAS Number:
1705578-24-0
Molecular Formula:
C9H9BF4KNO
Molecular Weight:
273.0768
MDL Number:
MFCD28805728
IUPAC Name:
potassium;trifluoro-[3-(4-fluoroanilino)-3-oxopropyl]boranuide
InChI:
InChI=1S/C9H9BF4NO.K/c11-7-1-3-8(4-2-7)15-9(16)5-6-10(12,13)14;/h1-4H,5-6H2,(H,15,16);/q-1;+1
InChI Key:
QBCVDRKZBBJBSF-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)F)CC[B-](F)(F)F.[K+]
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.035g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
273.079g/mol
Monoisotopic Mass:
273.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties