Home Aminos methyl 2,3-diamino-4-(trifluoromethyl)benzoate

methyl 2,3-diamino-4-(trifluoromethyl)benzoate

CAS No.:
913299-81-7
Catalog Number:
AG019ETQ
Molecular Formula:
C9H9F3N2O2
Molecular Weight:
234.1752
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$635
- +
Product Description
Catalog Number:
AG019ETQ
Chemical Name:
methyl 2,3-diamino-4-(trifluoromethyl)benzoate
CAS Number:
913299-81-7
Molecular Formula:
C9H9F3N2O2
Molecular Weight:
234.1752
MDL Number:
MFCD27932421
IUPAC Name:
methyl 2,3-diamino-4-(trifluoromethyl)benzoate
InChI:
InChI=1S/C9H9F3N2O2/c1-16-8(15)4-2-3-5(9(10,11)12)7(14)6(4)13/h2-3H,13-14H2,1H3
InChI Key:
YJMRBLWMFZDJAZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1N)N)C(F)(F)F
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.062g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.178g/mol
Monoisotopic Mass:
234.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties