(1S,2S,3R,4R)-3-Methylbicyclo[2.2.1]Hept-5-Ene-2-Carboxylic Acid
[CAS# 127179-45-7]

Identification

• Name: (1S,2S,3R,4R)-3-Methylbicyclo[2.2.1]Hept-5-Ene-2-Carboxylic Acid
• Synonyms: (1S,2S,3R,4R)-3-methylbicyclo[2.2.1]hept-5-ene-2-carboxylic acid
• Molecular Formula: C₉H₁₂O₂
• Molecular Weight: 152.19
• CAS Registry Number: 127179-45-7
• SMILES: O=C(O)[C@@H]2[C@@H]1\C=C/[C@@H](C1)[C@H]2C
• InChI: 1S/C9H12O2/c1-5-6-2-3-7(4-6)8(5)9(10)11/h2-3,5-8H,4H2,1H3,(H,10,11)/t5-,6+,7-,8+/m1/s1
• InChIKey: SSVKYZDOIWXDIO-CWKFCGSDSA-N

Properties

• Density: 1.164g/cm³ (Cal.)
• Boiling point: 268.674°C at 760 mmHg (Cal.)
• Flash point: 124.081°C (Cal.)
• Refractive index: 1.536 (Cal.)