Home Aminos methyl 4-amino-3-(2,2,2-trifluoroethoxy)benzoate

methyl 4-amino-3-(2,2,2-trifluoroethoxy)benzoate

CAS No.:
1096863-64-7
Catalog Number:
AG01AABY
Molecular Formula:
C10H10F3NO3
Molecular Weight:
249.1865
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Product Description
Catalog Number:
AG01AABY
Chemical Name:
methyl 4-amino-3-(2,2,2-trifluoroethoxy)benzoate
CAS Number:
1096863-64-7
Molecular Formula:
C10H10F3NO3
Molecular Weight:
249.1865
MDL Number:
MFCD12410243
IUPAC Name:
methyl 4-amino-3-(2,2,2-trifluoroethoxy)benzoate
InChI:
InChI=1S/C10H10F3NO3/c1-16-9(15)6-2-3-7(14)8(4-6)17-5-10(11,12)13/h2-4H,5,14H2,1H3
InChI Key:
OYZHTBVZZYAWAX-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)OCC(F)(F)F)N
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.061g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.189g/mol
Monoisotopic Mass:
249.061g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties