[(2R)-3,3-Dimethyl-2-Oxiranyl]Methyl 4-Nitrobenzoate
[CAS# 141700-91-6]

Identification

• Name: [(2R)-3,3-Dimethyl-2-Oxiranyl]Methyl 4-Nitrobenzoate
• Molecular Formula: C₁₂H₁₃NO₅
• Molecular Weight: 251.24
• CAS Registry Number: 141700-91-6
• SMILES: O=C(OC[C@H]1OC1(C)C)c2ccc(cc2)[N+]([O-])=O
• InChI: 1S/C12H13NO5/c1-12(2)10(18-12)7-17-11(14)8-3-5-9(6-4-8)13(15)16/h3-6,10H,7H2,1-2H3/t10-/m1/s1
• InChIKey: NNRORFCMFJMIKM-SNVBAGLBSA-N

Properties

• Density: 1.27g/cm³ (Cal.)
• Boiling point: 378.349°C at 760 mmHg (Cal.)
• Flash point: 167.238°C (Cal.)
• Refractive index: 1.546 (Cal.)