Name: Name:2H-1,4-Benzoxazine-7-carboxylic acid, 3,4-dihydro-2-methyl-3-oxo-, methyl ester
Brand: Angene
SKU: AG0021J2
Rating: 90 (10 reviews)

2H-1,4-Benzoxazine-7-carboxylic acid, 3,4-dihydro-2-methyl-3-oxo-, methyl ester

CAS No.:

179950-69-7

Catalog Number:

AG0021J2

Molecular Formula:

C11H11NO4

Molecular Weight:

221.2093

Catalog Number:

AG0021J2

Chemical Name:

2H-1,4-Benzoxazine-7-carboxylic acid, 3,4-dihydro-2-methyl-3-oxo-, methyl ester

CAS Number:

179950-69-7

Molecular Formula:

C11H11NO4

Molecular Weight:

221.2093

MDL Number:

MFCD11100233

IUPAC Name:

methyl 2-methyl-3-oxo-4H-1,4-benzoxazine-7-carboxylate

InChI:

InChI=1S/C11H11NO4/c1-6-10(13)12-8-4-3-7(11(14)15-2)5-9(8)16-6/h3-6H,1-2H3,(H,12,13)

InChI Key:

OLLPWCOGKLTZEW-UHFFFAOYSA-N

SMILES:

COC(=O)c1ccc2c(c1)OC(C(=O)N2)C

Complexity:

304

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

221.212g/mol

Monoisotopic Mass:

221.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1