Product Name

  • Name

    2H-INDAZOLE, 6-CHLORO-2-METHYL-

  • EINECS 604-604-1
  • CAS No. 541539-87-1
  • Density 1.3 g/cm3
  • Solubility
  • Melting Point
  • Formula C8H7ClN2
  • Boiling Point 299.8 °C at 760 mmHg
  • Molecular Weight 166.61
  • Flash Point 135.1 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 541539-87-1 (2H-INDAZOLE, 6-CHLORO-2-METHYL-)
  • Hazard Symbols
  • Synonyms 6-Chloro-2-methyl-2H-indazole;
  • PSA 17.82000
  • LogP 2.22670

2H-Indazole,6-chloro-2-methyl- Specification

The CAS register number of 2H-Indazole,6-chloro-2-methyl- is 541539-87-1. The systematic name about this chemical is 6-chloro-2-methyl-2H-indazole. The molecular formula about this chemical is C8H7ClN2 and the molecular weight is 166.61.

Physical properties about 2H-Indazole,6-chloro-2-methyl- are: (1)ACD/LogP: 2.41; (2)ACD/LogD (pH 5.5): 2.41; (3)ACD/LogD (pH 7.4): 2.41; (4)ACD/BCF (pH 5.5): 39.61; (5)ACD/BCF (pH 7.4): 39.61; (6)ACD/KOC (pH 5.5): 484.57; (7)ACD/KOC (pH 7.4): 484.57; (8)#H bond acceptors: 2; (9)Polar Surface Area: 17.82 Å2; (10)Index of Refraction: 1.632; (11)Molar Refractivity: 45.73 cm3; (12)Molar Volume: 128.1 cm3; (13)Polarizability: 18.13x10-24cm3; (14)Surface Tension: 43.3 dyne/cm; (15)Density: 1.3 g/cm3; (16)Flash Point: 135.1 °C; (17)Enthalpy of Vaporization: 51.82 kJ/mol; (18)Boiling Point: 299.8 °C at 760 mmHg; (19)Vapour Pressure: 0.00208 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccc1c(nn(c1)C)c2
(2)InChI: InChI=1/C8H7ClN2/c1-11-5-6-2-3-7(9)4-8(6)10-11/h2-5H,1H3
(3)InChIKey: VMLMCURMWQPXSP-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C8H7ClN2/c1-11-5-6-2-3-7(9)4-8(6)10-11/h2-5H,1H3
(5)Std. InChIKey: VMLMCURMWQPXSP-UHFFFAOYSA-N

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