4H-1,4-BENZOXAZINE-4-ACETIC ACID, 6-ACETYL-2,3-DIHYDRO-3-OXO-

2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid

CAS: 91119-94-7

Molecular Formula	`C12H11NO5`
Molecular Weight	249.22 g/mol
LogP	0.3
Topological Polar Surface Area	83.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	249.06372
Heavy Atoms	18
Complexity	381.0

Chemical Identifiers

CAS Number	91119-94-7
SMILES	`CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)O`
InChIKey	`HGSUZDHHTKSDHN-UHFFFAOYSA-N`

📖 Product Overview

4H-1,4-BENZOXAZINE-4-ACETIC ACID, 6-ACETYL-2,3-DIHYDRO-3-OXO- (CAS: 91119-94-7) is a chemical compound with molecular formula C12H11NO5 and molecular weight 249.22 g/mol. Its IUPAC systematic name is 2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid. LogP 0.3 Topological Polar Surface Area 83.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 249.06372 Heavy Atoms 18 Complexity 381.0 InChI Key: HGSUZDHHTKSDHN-UHFFFAOYSA-N. SMILES: CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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