Home Aminos 8-amino-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one

8-amino-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one

CAS No.:
459191-31-2
Catalog Number:
AG019U0G
Molecular Formula:
C9H7F3N2O2
Molecular Weight:
232.1593
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019U0G
Chemical Name:
8-amino-6-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazin-3-one
CAS Number:
459191-31-2
Molecular Formula:
C9H7F3N2O2
Molecular Weight:
232.1593
MDL Number:
MFCD02976976
IUPAC Name:
8-amino-6-(trifluoromethyl)-4H-1,4-benzoxazin-3-one
InChI:
InChI=1S/C9H7F3N2O2/c10-9(11,12)4-1-5(13)8-6(2-4)14-7(15)3-16-8/h1-2H,3,13H2,(H,14,15)
InChI Key:
TWGPRVZKUXCWRK-UHFFFAOYSA-N
SMILES:
O=C1COc2c(N1)cc(cc2N)C(F)(F)F
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.046g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
232.162g/mol
Monoisotopic Mass:
232.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties