Basic information
- CAS
3734-92-7- Standard SMILES
CCOP(=O)(OCC)SCN1C(=O)c2ccccc2C1=O- InChIKey
REXZMTNLSRBELZ-UHFFFAOYSA-N- Molecular formula
- C13H16NO5PS
- Average molar mass
- 329.31 g/mol
- Monoisotopic mass
- 329.04868078
Names & identifiers
- Preferred name
- AI 3-25706
- IUPAC
- 2-(diethoxyphosphorylsulfanylmethyl)isoindole-1,3-dione
- English name
- Thiophosphoric acid S-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]O,O-diethyl ester
- Molecular weight
- 0
Names & synonyms
3734-92-7AI 3-25706DTXSID70190785RefChem:1076235DTXCID101132762-(diethoxyphosphorylsulfanylmethyl)isoindole-1,3-dionePhosphorothioic acid, O,O-diethyl S-(phthalimidomethyl) esterStauffer R-1505Thiophosphoric acid S-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]O,O-diethyl esterR 1505ENT 25,706BRN 0287057
Show more names
R-1505ENT-25706AI-3-25706Stauffer R 1505Thiophosphoric acid O,O-diethyl S-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl ester
AI3-25706Phosphorothioic acid, O,O-diethyl ester, S-ester with N-(mercaptomethyl)phthalimide (7CI,8CI)orb1703772REXZMTNLSRBELZ-UHFFFAOYSA-NAKOS040745536Phosphorothioic acid, O,O-diethyl ester, S-ester with N-(mercaptomethyl)phthalimidePhosphorothioic acid, S-((1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl) O,O-diethyl esterT23691
Database identifiers
- CAS
3734-92-7- PubChem CID
- 77321
- DTXSID
DTXSID70190785- Nikkaji
- J8.229E
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 98.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 424
Chemistry & industry
Applications
DescriptionAI 3-25706 is a pesticide.
Suppliers2 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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