2-Methyl-2-Propanyl 1,3,3A,4,7,7A-Hexahydro-2H-Isoindole-2-Carboxylate
[CAS# 474925-37-6]

Identification

• Name: 2-Methyl-2-Propanyl 1,3,3A,4,7,7A-Hexahydro-2H-Isoindole-2-Carboxylate
• Synonyms: 1,3,3a,4,7,7a-Hexahydro-2H-isoindole-2-carboxylate de 2-méthyl-2-propanyle; 2H-Isoindole-2-carboxylic acid, 1,3,3a,4,7,7a-hexahydro-, 1,1-dimethylethyl ester; 2-Methyl-2-propanyl 1,3,3a,4,7,7a-hexahydro-2H-isoindole-2-carboxylate
• Molecular Formula: C₁₃H₂₁NO₂
• Molecular Weight: 223.31
• CAS Registry Number: 474925-37-6
• SMILES: CC(C)(C)OC(=O)N1CC2CC=CCC2C1
• InChI: 1S/C13H21NO2/c1-13(2,3)16-12(15)14-8-10-6-4-5-7-11(10)9-14/h4-5,10-11H,6-9H2,1-3H3
• InChIKey: BQRMVHVRBBRSOH-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 298.6±29.0°C at 760 mmHg (Cal.)
• Flash point: 134.4±24.3°C (Cal.)
• Refractive index: 1.505 (Cal.)

Safety Data

• Safety Description: IRRITANT