O-(2-methylpropyl) [2-oxo-2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]sulfanylmethanethioate

CAS: 90619-16-2

Molecular Formula	`C15H17NO4S2`
Molecular Weight	339.4 g/mol
LogP	3.6
Topological Polar Surface Area	113.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	339.0599
Heavy Atoms	22
Complexity	441.0

Chemical Identifiers

CAS Number	90619-16-2
SMILES	`CC(C)COC(=S)SCC(=O)N1C(=O)COC2=CC=CC=C21`
InChIKey	`RTZXWLZRYBZQMK-UHFFFAOYSA-N`

📖 Product Overview

O-(2-methylpropyl) [2-oxo-2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]sulfanylmethanethioate (CAS: 90619-16-2) is a chemical compound with molecular formula C15H17NO4S2 and molecular weight 339.4 g/mol. Its IUPAC systematic name is O-(2-methylpropyl) [2-oxo-2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]sulfanylmethanethioate. LogP 3.6 Topological Polar Surface Area 113.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 339.0599 Heavy Atoms 22 Complexity 441.0 InChI Key: RTZXWLZRYBZQMK-UHFFFAOYSA-N. SMILES: CC(C)COC(=S)SCC(=O)N1C(=O)COC2=CC=CC=C21.

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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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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for O-(2-methylpropyl) [2-oxo-2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]sulfanylmethanethioate.

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