Home Aminos potassium trifluoro(3-((3-nitrophenyl)amino)-3-oxopropyl)borate

potassium trifluoro(3-((3-nitrophenyl)amino)-3-oxopropyl)borate

CAS No.:
1705578-38-6
Catalog Number:
AG00ARSR
Molecular Formula:
C9H9BF3KN2O3
Molecular Weight:
300.0839
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Product Description
Catalog Number:
AG00ARSR
Chemical Name:
potassium trifluoro(3-((3-nitrophenyl)amino)-3-oxopropyl)borate
CAS Number:
1705578-38-6
Molecular Formula:
C9H9BF3KN2O3
Molecular Weight:
300.0839
MDL Number:
MFCD28805727
IUPAC Name:
potassium;trifluoro-[3-(3-nitroanilino)-3-oxopropyl]boranuide
InChI:
InChI=1S/C9H9BF3N2O3.K/c11-10(12,13)5-4-9(16)14-7-2-1-3-8(6-7)15(17)18;/h1-3,6H,4-5H2,(H,14,16);/q-1;+1
InChI Key:
KMLYLOGVVMNSRQ-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc(c1)[N+](=O)[O-])CC[B-](F)(F)F.[K+]
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.03g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
300.086g/mol
Monoisotopic Mass:
300.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties