N-(((((5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yl)(1,1-dimethylethyl)thio)methylamino)carbonyl)oxy)-Ethanimidothioic acid methyl ester P-sulfide
[CAS# 72542-56-4]

Identification

• Name: N-(((((5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yl)(1,1-dimethylethyl)thio)methylamino)carbonyl)oxy)-Ethanimidothioic acid methyl ester P-sulfide
• Synonyms: (1-Methylsulfanylethylideneamino) N-[Tert-Butyl-(5,5-Dimethyl-2-Thioxo-1,3-Dioxa-2$L^{5}-Phosphacyclohex-2-Yl)Amino]Sulfanyl-N-Methyl-Carbamate; N-[[Tert-Butyl-(5,5-Dimethyl-2-Thioxo-1,3-Dioxa-2$L^{5}-Phosphacyclohex-2-Yl)Amino]Thio]-N-Methylcarbamic Acid [1-(Methylthio)Ethylideneamino] Ester; N-[[Tert-Butyl-(5,5-Dimethyl-2-Thioxo-1,3-Dioxa-2$L^{5}-Phosphacyclohex-2-Yl)Amino]Thio]-N-Methyl-Carbamic Acid [1-(Methylthio)Ethylideneamino] Ester
• Molecular Formula: C₁₄H₂₈N₃O₄PS₃
• Molecular Weight: 429.55
• CAS Registry Number: 72542-56-4
• SMILES: CSC(=N/OC(N(SN([P]1(=S)OCC(CO1)(C)C)C(C)(C)C)C)=O)/C
• InChI: 1S/C14H28N3O4PS3/c1-11(24-8)15-21-12(18)16(7)25-17(13(2,3)4)22(23)19-9-14(5,6)10-20-22/h9-10H2,1-8H3/b15-11+
• InChIKey: ATEBGFOYQXZUEB-RVDMUPIBSA-N

Properties

• Density: 1.284g/cm³ (Cal.)
• Boiling point: 458.399°C at 760 mmHg (Cal.)
• Flash point: 231.031°C (Cal.)