Home Carboxys methyl 6-(trifluoroacetyl)-3,4-dihydro-2H-oxazine-4-carboxylate

methyl 6-(trifluoroacetyl)-3,4-dihydro-2H-oxazine-4-carboxylate

CAS No.:
2138051-85-9
Catalog Number:
AG01EM8L
Molecular Formula:
C8H8F3NO4
Molecular Weight:
239.1486
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Product Description
Catalog Number:
AG01EM8L
Chemical Name:
methyl 6-(trifluoroacetyl)-3,4-dihydro-2H-oxazine-4-carboxylate
CAS Number:
2138051-85-9
Molecular Formula:
C8H8F3NO4
Molecular Weight:
239.1486
MDL Number:
MFCD31559288
IUPAC Name:
methyl 6-(2,2,2-trifluoroacetyl)-2,3-dihydro-1,4-oxazine-4-carboxylate
InChI:
InChI=1S/C8H8F3NO4/c1-15-7(14)12-2-3-16-5(4-12)6(13)8(9,10)11/h4H,2-3H2,1H3
InChI Key:
YBJIJMFHYPWKCQ-UHFFFAOYSA-N
SMILES:
COC(=O)N1CCOC(=C1)C(=O)C(F)(F)F
Properties
Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.041g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.15g/mol
Monoisotopic Mass:
239.041g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties