3-Bromo-5-Methyl-Tricyclo[3.3.1.1(3,7)]Decane-1-Carboxylicacid
[CAS# 14670-95-2]

Identification

• Name: 3-Bromo-5-Methyl-Tricyclo[3.3.1.1(3,7)]Decane-1-Carboxylicacid
• Synonyms: 3-Bromo-5-Methyl-Adamantane-1-Carboxylic Acid; 3-Bromo-5-Methyl-1-Adamantanecarboxylic Acid; 3-Bromo-7-Methyl-1-Adamantanecarboxylic Acid
• Molecular Formula: C₁₂H₁₇BrO₂
• Molecular Weight: 273.17
• CAS Registry Number: 14670-95-2
• SMILES: CC23CC1(CC(CC(C1)C2)(Br)C3)C(O)=O
• InChI: 1S/C12H17BrO2/c1-10-2-8-3-11(5-10,9(14)15)7-12(13,4-8)6-10/h8H,2-7H2,1H3,(H,14,15)
• InChIKey: AQYMJKFAOHCXOD-UHFFFAOYSA-N

Properties

• Density: 1.604g/cm³ (Cal.)
• Boiling point: 349.943°C at 760 mmHg (Cal.)
• Flash point: 165.44°C (Cal.)