Home Aminos ethyl 2-amino-3,4,6-trifluorobenzoate

ethyl 2-amino-3,4,6-trifluorobenzoate

CAS No.:
1343057-71-5
Catalog Number:
AG01EJFR
Molecular Formula:
C9H8F3NO2
Molecular Weight:
219.1605
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Product Description
Catalog Number:
AG01EJFR
Chemical Name:
ethyl 2-amino-3,4,6-trifluorobenzoate
CAS Number:
1343057-71-5
Molecular Formula:
C9H8F3NO2
Molecular Weight:
219.1605
MDL Number:
MFCD17227186
IUPAC Name:
ethyl 2-amino-3,4,6-trifluorobenzoate
InChI:
InChI=1S/C9H8F3NO2/c1-2-15-9(14)6-4(10)3-5(11)7(12)8(6)13/h3H,2,13H2,1H3
InChI Key:
LFLKMTQCGQHAPO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(F)cc(c(c1N)F)F
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.051g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.163g/mol
Monoisotopic Mass:
219.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties