79522

tert-Butyl P,P-dimethylphosphonoacetate

≥97.0% (GC)

• Sinônimo(s): tert-Butyl ((oxo)dimethoxyphosphino)acetate, tert-Butyl (dimethoxyphosphinyl)acetate, Dimethyl (tert-butoxycarbonyl)methylphosphonate
• Fórmula linear: (CH₃O)₂P(O)CH₂COOC(CH₃)₃
• Número CAS: 62327-21-3
• Peso molecular: 224.19
• Beilstein: 4861886
• Número MDL: MFCD00042939
• Código UNSPSC: 12352108
• ID de substância PubChem: 57652799
• NACRES: NA.22

Propriedades

• Nível de qualidade: 100
• Ensaio: ≥97.0% (GC)
• Formulário: liquid
• adequação da reação: reaction type: C-C Bond Formation
• índice de refração: n20/D 1.434
• p.e.: 86-87 °C/0.02 mmHg (lit.)
• densidade: 1.131 g/mL at 20 °C (lit.)
• grupo funcional: ester; phosphonate
• cadeia de caracteres SMILES: COP(=O)(CC(=O)OC(C)(C)C)OC
• InChI: 1S/C8H17O5P/c1-8(2,3)13-7(9)6-14(10,11-4)12-5/h6H2,1-5H3
• chave InChI: SAZYDWOWLRDDRQ-UHFFFAOYSA-N

Descrição

Aplicação

Reactant for:

• Preparation of phosphonate terminated PPH dendrimers as anti-HIV-1 agents
• Preparation of monodehydro diketopiperazines from ketoacyl amino acid amides via acid-catalyzed cyclization
• Preparation of α,β-unsaturated esters for use in the guanidine-catalyzed oxa-Michael addition
• Preparation of myxopyronin B and desmethyl myxopyronin B analogs, with antibacterial activity and inhibitory activity against bacterial RNA polymerase
• Allylation and subsequent ring-closing metathesis in presence of Grubbs′ catalyst or intramolecular rhodium-catalyzed cyclopropanation reactions

Outras notas

Horner-Wittig reagent giving preferentially (E)-α,β-unsat. esters which are mildly saponified with acid. Synthesis of derivatives by reductive alkylation

Informações de segurança

• Pictogramas: GHS07
• Palavra indicadora: Warning
• Frases de perigo: H315,H319,H335
• Declarações de precaução: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Classificações de perigo: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Órgãos-alvo: Respiratory system
• Código de classe de armazenamento: 10 - Combustible liquids
• Classe de risco de água (WGK): WGK 3
• Ponto de fulgor (°F): 230.0 °F - closed cup
• Ponto de fulgor (°C): 110.0 °C - closed cup
• Equipamento de proteção individual: Eyeshields, Gloves, type ABEK (EN14387) respirator filter