Product Name

  • Name

    4-BROMO-3,5-DIMETHYL-BENZAMIDE

  • EINECS
  • CAS No. 864825-81-0
  • Density 1.454 g/cm3
  • Solubility
  • Melting Point
  • Formula C9H10BrNO
  • Boiling Point 261.1 °C at 760 mmHg
  • Molecular Weight 228.088
  • Flash Point 111.7 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 864825-81-0 (4-BROMO-3,5-DIMETHYL-BENZAMIDE)
  • Hazard Symbols
  • Synonyms Benzamide, 4-bromo-3,5-dimethyl-;
  • PSA 43.09000
  • LogP 2.86510

4-Bromo-3,5-dimethylbenzamide Specification

The CAS register number of 4-Bromo-3,5-dimethylbenzamide is 864825-81-0. It also can be called as Benzamide,4-bromo-3,5-dimethyl- and the systematic name about this chemical is 4-bromo-3,5-dimethyl-benzamide. The molecular formula about this chemical is C9H10BrNO and the molecular weight is 228.09.

Physical properties about 4-Bromo-3,5-dimethylbenzamide are: (1)ACD/LogP: 2.68; (2)ACD/LogD (pH 5.5): 2.68; (3)ACD/LogD (pH 7.4): 2.68 ; (4)#H bond acceptors: 2; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 1; (7)Polar Surface Area: 43.09Å2; (8)Index of Refraction: 1.584; (9)Molar Refractivity: 52.52 cm3; (10)Molar Volume: 156.8 cm3; (11)Polarizability: 20.82x10-24cm3; (12)Surface Tension: 45.5 dyne/cm; (13)Enthalpy of Vaporization: 49.88 kJ/mol; (14)Boiling Point: 261.1 °C at 760 mmHg; (15)Vapour Pressure: 0.0118 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(cc(C)c1Br)C(N)=O
(2)InChI: InChI=1/C9H10BrNO/c1-5-3-7(9(11)12)4-6(2)8(5)10/h3-4H,1-2H3,(H2,11,12)
(3)InChIKey: ATWMWAQQPBRPCA-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C9H10BrNO/c1-5-3-7(9(11)12)4-6(2)8(5)10/h3-4H,1-2H3,(H2,11,12)
(5)Std. InChIKey: ATWMWAQQPBRPCA-UHFFFAOYSA-N

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