(1R,2S,4R)-4,7,7-Trimethyl-3-Oxo-Bicyclo[2.2.1]Heptane-2-Carboxylicacid
[CAS# 18530-30-8]

Identification

• Name: (1R,2S,4R)-4,7,7-Trimethyl-3-Oxo-Bicyclo[2.2.1]Heptane-2-Carboxylicacid
• Synonyms: 4,7,7-Trimethyl-3-Oxo-Norbornane-2-Carboxylic Acid; 4,7,7-Trimethyl-3-Oxo-2-Norbornanecarboxylic Acid; 3-Keto-4,7,7-Trimethyl-Norbornane-2-Carboxylic Acid
• Molecular Formula: C₁₁H₁₆O₃
• Molecular Weight: 196.25
• CAS Registry Number: 18530-30-8
• EINECS: 242-404-1
• SMILES: CC1(C2C(C(=O)C1(C)CC2)C(O)=O)C
• InChI: 1S/C11H16O3/c1-10(2)6-4-5-11(10,3)8(12)7(6)9(13)14/h6-7H,4-5H2,1-3H3,(H,13,14)
• InChIKey: XNMVAVGXJZFTEH-UHFFFAOYSA-N

Properties

• Density: 1.174g/cm³ (Cal.)
• Boiling point: 317.659°C at 760 mmHg (Cal.)
• Flash point: 160.131°C (Cal.)