3A,4,5,6,7,7alpha-Hexahydro-4,7-Methano-1H-Inden-6-Ol 6-Propanoate
[CAS# 17511-60-3]

Identification

• Classification: Flavors and spices >> Synthetic spice >> Carboxylic acid and ester perfume >> Aliphatic carboxylate
• Name: 3A,4,5,6,7,7alpha-Hexahydro-4,7-Methano-1H-Inden-6-Ol 6-Propanoate
• Synonyms: 4,7-Methanoinden-6-Ol, 3A,4,5,6,7,7A-Hexahydro-, Propionate; 4,7-Methanoinden-6-Ol, 3A,4,5,6,7,7A-Hexahydro-, Propionate (8Ci); 4,7-Methanoindene-6-Carboxylic Acid, 3A,4,5,6,7,7A-Hexahydro-, Ethyl Ester
• Molecular Formula: C₁₃H₁₈O₂
• Molecular Weight: 206.28
• CAS Registry Number: 17511-60-3
• EINECS: 241-514-7
• SMILES: C(C(OC2C1C3C(C(C1)C2)C=CC3)=O)C
• InChI: 1S/C13H18O2/c1-2-13(14)15-12-7-8-6-11(12)10-5-3-4-9(8)10/h3-4,8-12H,2,5-7H2,1H3
• InChIKey: BLBJUGKATXCWET-UHFFFAOYSA-N

Properties

• Density: 1.105g/cm³ (Cal.)
• Boiling point: 276.155°C at 760 mmHg (Cal.)
• Flash point: 112.864°C (Cal.)