Product Name

  • Name

    2,3-dibromopropyl hexanoate

  • EINECS
  • CAS No. 6308-04-9
  • Density 1.524 g/cm3
  • Solubility
  • Melting Point
  • Formula C9H16Br2O2
  • Boiling Point 323.9 °C at 760 mmHg
  • Molecular Weight 316.0301
  • Flash Point 149.7 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 6308-04-9 (2,3-dibromopropyl hexanoate)
  • Hazard Symbols
  • Synonyms NSC43351;
  • PSA
  • LogP

Hexanoic acid, 2,3-dibromopropyl ester Specification

The CAS registry number of Hexanoic acid, 2,3-dibromopropyl ester is 6308-04-9. This chemical's molecular formula is C9H16Br2O2 and molecular weight is 316.0301. What's more, its systematic name is 2,3-Dibromopropyl hexanoate.

Physical properties about Hexanoic acid, 2,3-dibromopropyl ester are: (1)ACD/LogP: 4.35; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 8; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.499; (8)Molar Refractivity: 60.94 cm3; (9)Molar Volume: 207.3 cm3; (10)Polarizability: 24.15×10-24 cm3; (11)Surface Tension: 38.5 dyne/cm; (12)Density: 1.524 g/cm3; (13)Flash Point: 149.7 °C; (14)Enthalpy of Vaporization: 56.59 kJ/mol; (15)Boiling Point: 323.9 °C at 760 mmHg; (16)Vapour Pressure: 0.000254 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: BrCC(Br)COC(=O)CCCCC
(2)InChI: InChI=1/C9H16Br2O2/c1-2-3-4-5-9(12)13-7-8(11)6-10/h8H,2-7H2,1H3
(3)InChIKey: MHCMWLLEMJCJCZ-UHFFFAOYAD

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