Product Name

  • Name

    7-BENZOYLOXYNORBORNADIENE

  • EINECS
  • CAS No. 4796-68-3
  • Article Data2
  • CAS DataBase
  • Density 1.2 g/cm3
  • Solubility
  • Melting Point 53-54 °C
  • Formula C14H12O2
  • Boiling Point 318.3 °C at 760 mmHg
  • Molecular Weight 212.248
  • Flash Point 143.9 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 4796-68-3 (7-BENZOYLOXYNORBORNADIENE)
  • Hazard Symbols
  • Synonyms 2,5-Norbornadien-7-ol,benzoate (7CI,8CI);Bicyclo[2.2.1]hepta-2,5-dien-7-ol, benzoate (9CI);7-(Benzoyloxy)norbornadiene;Bicyclo[2.2.1]hepta-2,5-dien-7-yl benzoate;NSC122985;
  • PSA 26.30000
  • LogP 2.58400

Bicyclo[2.2.1]hepta-2,5-dien-7-ol,7-benzoate Specification

The Bicyclo[2.2.1]hepta-2,5-dien-7-ol,7-benzoate, with the CAS registry number 4796-68-3, is also known as 7-Benzoyloxynorbornadiene. This chemical's molecular formula is C14H12O2 and molecular weight is 212.2439. What's more, its IUPAC name is 7-Bicyclo[2.2.1]hepta-2,5-dienyl benzoate.

Physical properties about Bicyclo[2.2.1]hepta-2,5-dien-7-ol,7-benzoate are: (1)ACD/LogP: 3.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.03; (4)ACD/LogD (pH 7.4): 3.03; (5)ACD/BCF (pH 5.5): 118.25; (6)ACD/BCF (pH 7.4): 118.25; (7)ACD/KOC (pH 5.5): 1060.03; (8)ACD/KOC (pH 7.4): 1060.03; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.614; (14)Molar Refractivity: 61.32 cm3; (15)Molar Volume: 175.7 cm3; (16)Polarizability: 24.3×10-24cm3; (17)Surface Tension: 46.8 dyne/cm; (18)Density: 1.2 g/cm3; (19)Flash Point: 143.9 °C; (20)Enthalpy of Vaporization: 55.98 kJ/mol; (21)Boiling Point: 318.3 °C at 760 mmHg; (22)Vapour Pressure: 0.000364 mmHg at 25 °C.

Use of Bicyclo[2.2.1]hepta-2,5-dien-7-ol,7-benzoate: it is used to produce other chemicals. For example, it is used to produce 7-Benzoyloxy-quadricyclan. The reaction occurs with solvent Cyclohexane. The yield is 81 %.

Bicyclo[2.2.1]hepta-2,5-dien-7-ol,7-benzoate is used to produce 7-Benzoyloxy-quadricyclan

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OC2C/1\C=C/C2\C=C\1)c3ccccc3
(2) InChI: InChI=1/C14H12O2/c15-14(12-4-2-1-3-5-12)16-13-10-6-7-11(13)9-8-10/h1-11,13H
(3) InChIKey: NTELHPJRBBSUIJ-UHFFFAOYAD

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