methyl 2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)acetate

CAS: 91119-95-8

Molecular Formula	`C13H13NO5`
Molecular Weight	263.25 g/mol
LogP	0.7
Topological Polar Surface Area	72.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	263.07938
Heavy Atoms	19
Complexity	394.0

Chemical Identifiers

CAS Number	91119-95-8
SMILES	`CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)OC`
InChIKey	`NFYSFNBYBHZWAL-UHFFFAOYSA-N`

📖 Product Overview

methyl 2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)acetate (CAS: 91119-95-8) is a chemical compound with molecular formula C13H13NO5 and molecular weight 263.25 g/mol. Its IUPAC systematic name is methyl 2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)acetate. LogP 0.7 Topological Polar Surface Area 72.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 263.07938 Heavy Atoms 19 Complexity 394.0 InChI Key: NFYSFNBYBHZWAL-UHFFFAOYSA-N. SMILES: CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)OC.

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