(1Z,5Z,8S)-1,5-Dimethyl-8-Prop-1-En-2-Ylcyclodeca-1,5-Diene
[CAS# 75023-40-4]

Identification

• Name: (1Z,5Z,8S)-1,5-Dimethyl-8-Prop-1-En-2-Ylcyclodeca-1,5-Diene
• Synonyms: (1Z,5Z,8S)-8-Isopropenyl-1,5-Dimethyl-Cyclodeca-1,5-Diene; (1Z,5Z,8S)-8-Isopropenyl-1,5-Dimethylcyclodeca-1,5-Diene; (1Z,5Z,8S)-1,5-Dimethyl-8-Prop-1-En-2-Yl-Cyclodeca-1,5-Diene
• Molecular Formula: C₁₅H₂₄
• Molecular Weight: 204.35
• CAS Registry Number: 75023-40-4 (28387-44-2)
• SMILES: [C@@H]1(C(=C)C)C/C=C(CC/C=C(CC1)/C)/C
• InChI: 1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9,15H,1,5,7-8,10-11H2,2-4H3/b13-6-,14-9-/t15-/m0/s1
• InChIKey: XMRKUJJDDKYUHV-ZCGSDFCLSA-N

Properties

• Density: 0.832g/cm³ (Cal.)
• Boiling point: 281.753°C at 760 mmHg (Cal.)
• Flash point: 112.892°C (Cal.)

References

• (1): Miller David J.. Competitive inhibition of aristolochene synthase by phenyl-substituted farnesyl diphosphates: evidence of active site plasticity, Organic & Biomolecular Chemistry, 2007