Product Name

  • Name

    3-(Chloromethyl)-5-methylpyridine hydrochloride

  • EINECS
  • CAS No. 1007089-84-0
  • Article Data6
  • CAS DataBase
  • Density 1.118 g/cm3
  • Solubility
  • Melting Point
  • Formula C7H8ClN
  • Boiling Point 232.233 °C at 760 mmHg
  • Molecular Weight 178.061
  • Flash Point 116.576 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 1007089-84-0 (3-(Chloromethyl)-5-methylpyridine hydrochloride)
  • Hazard Symbols
  • Synonyms 3-Chloromethyl-5-methylpyridine Hydrochloride
  • PSA 12.89000
  • LogP 2.12880

3-(Chloromethyl)-5-methylpyridine hydrochloride Specification

The 3-(Chloromethyl)-5-methylpyridine hydrochloride, with its CAS registry number 1007089-84-0, has the systematic name of 3-(chloromethyl)-5-methylpyridine. And it has the molecular formula of C7H8ClN. Besides, it is a kind of harmful chemical, so you should be careful while dealing with this chemical. In addition, this is a kind of irritant chemical which may cause inflammation to the skin or other mucous membranes, so you should be very careful while using.

The characteristics of 3-(Chloromethyl)-5-methylpyridine hydrochloride are as follows: (1)ACD/LogP: 1.80; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 12.89 Å2; (7)Index of Refraction: 1.527; (8)Molar Refractivity: 38.935 cm3; (9)Molar Volume: 126.628 cm3; (10)Polarizability: 15.435×10-24cm3; (11)Surface Tension: 37.964 dyne/cm; (12)Density: 1.118 g/cm3; (13)Flash Point: 116.576 °C; (14)Enthalpy of Vaporization: 44.987 kJ/mol; (15)Boiling Point: 232.233 °C at 760 mmHg; (16)Vapour Pressure: 0.091 mmHg at 25°C.

What's more, the following datas could be converted into the molecular structure:
(1)SMILES:ClCc1cc(cnc1)C
(2)InChI:InChI=1/C7H8ClN/c1-6-2-7(3-8)5-9-4-6/h2,4-5H,3H2,1H3
(3)InChIKey:DZZYVVUYEDSKBU-UHFFFAOYAM
(4)Std. InChI:InChI=1S/C7H8ClN/c1-6-2-7(3-8)5-9-4-6/h2,4-5H,3H2,1H3
(5)Std. InChIKey:DZZYVVUYEDSKBU-UHFFFAOYSA-N

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