[(2S)-2-Methyloxiran-2-Yl]Methyl 4-Nitrobenzoate
[CAS# 118200-96-7]

Identification

• Classification: Chemical reagent >> Organic reagent >> Epoxide
• Name: [(2S)-2-Methyloxiran-2-Yl]Methyl 4-Nitrobenzoate
• Synonyms: 4-Nitrobenzoic Acid [(2S)-2-Methyl-2-Oxiranyl]Methyl Ester; 4-Nitrobenzoic Acid [(2S)-2-Methyloxiran-2-Yl]Methyl Ester; (2S)-(+)-(2,3-Epoxy-2-Methylpropylester)-4-Nitrobenzoate
• Molecular Formula: C₁₁H₁₁NO₅
• Molecular Weight: 237.21
• CAS Registry Number: 118200-96-7
• SMILES: [C@]2(COC(C1=CC=C([N+](=O)[O-])C=C1)=O)(CO2)C
• InChI: 1S/C11H11NO5/c1-11(7-17-11)6-16-10(13)8-2-4-9(5-3-8)12(14)15/h2-5H,6-7H2,1H3/t11-/m1/s1
• InChIKey: PUBTVFBOTFDPTA-LLVKDONJSA-N

Properties

• Density: 1.333g/cm³ (Cal.)
• Boiling point: 375.95°C at 760 mmHg (Cal.)
• Flash point: 174.035°C (Cal.)