Home Aminos Methyl 2-amino-5-methyl-4-(trifluoromethyl)benzoate

Methyl 2-amino-5-methyl-4-(trifluoromethyl)benzoate

CAS No.:
872624-53-8
Catalog Number:
AG008ELV
Molecular Formula:
C10H10F3NO2
Molecular Weight:
233.1871
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Product Description
Catalog Number:
AG008ELV
Chemical Name:
Methyl 2-amino-5-methyl-4-(trifluoromethyl)benzoate
CAS Number:
872624-53-8
Molecular Formula:
C10H10F3NO2
Molecular Weight:
233.1871
MDL Number:
MFCD11111106
IUPAC Name:
methyl 2-amino-5-methyl-4-(trifluoromethyl)benzoate
InChI:
InChI=1S/C10H10F3NO2/c1-5-3-6(9(15)16-2)8(14)4-7(5)10(11,12)13/h3-4H,14H2,1-2H3
InChI Key:
MIEPONYZJUGILI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(C)c(cc1N)C(F)(F)F
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.066g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.19g/mol
Monoisotopic Mass:
233.066g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties