(3-Nitrophenyl)Methyl (Z)-3-Dimethoxyphosphoryloxybut-2-Enoate
[CAS# 3734-58-5]

Identification

• Name: (3-Nitrophenyl)Methyl (Z)-3-Dimethoxyphosphoryloxybut-2-Enoate
• Synonyms: (Z)-3-Dimethoxyphosphoryloxybut-2-Enoic Acid (3-Nitrophenyl)Methyl Ester; (Z)-3-Dimethoxyphosphoryloxybut-2-Enoic Acid (3-Nitrobenzyl) Ester; 2-Butenoic Acid, 3-((Dimethoxyphosphinyl)Oxy)-, (3-Nitrophenyl)Methyl Ester (9Ci)
• Molecular Formula: C₁₃H₁₆NO₈P
• Molecular Weight: 345.25
• CAS Registry Number: 3734-58-5
• SMILES: C1=C(COC(=O)/C=C(O[P](OC)(OC)=O)/C)C=CC=C1[N+]([O-])=O
• InChI: 1S/C13H16NO8P/c1-10(22-23(18,19-2)20-3)7-13(15)21-9-11-5-4-6-12(8-11)14(16)17/h4-8H,9H2,1-3H3/b10-7-
• InChIKey: QHMCMUZANLPSPL-YFHOEESVSA-N

Properties

• Density: 1.345g/cm³ (Cal.)
• Boiling point: 435.124°C at 760 mmHg (Cal.)
• Flash point: 216.956°C (Cal.)