1,3-Cycloheptadiene
[CAS# 4054-38-0]

Identification

• Classification: Organic raw materials >> Hydrocarbon compounds and their derivatives >> Cyclic hydrocarbon
• Name: 1,3-Cycloheptadiene
• Synonyms: 157996_Aldrich; 28800_Fluka; 1,3-Cycloheptadiene
• Molecular Formula: C₇H₁₀
• Molecular Weight: 94.16
• CAS Registry Number: 4054-38-0
• EINECS: 223-762-8
• SMILES: C1CC=CC=CC1
• InChI: 1S/C7H10/c1-2-4-6-7-5-3-1/h1-4H,5-7H2
• InChIKey: GWYPDXLJACEENP-UHFFFAOYSA-N

Properties

• Density: 0.85g/cm³ (Cal.)
• Boiling point: 120.499°C at 760 mmHg (Cal.)
• Flash point: 11.111°C (Cal.)

References

• (1): Robert S. Atkinson and Christopher K. Meades. Aziridination of cyclic dienes with enantiopure 3-acetoxyaminoquinazolin-4(3H)-ones, J. Chem. Soc., Perkin Trans. 1, 2001, 0, 1518.