Product Name

  • Name

    methyl 1,2,3,4-tetrahydroisoquinoline-4-carboxylate

  • EINECS
  • CAS No. 681448-82-8
  • Density 1.125±0.06 g/cm3(Predicted)
  • Solubility
  • Melting Point
  • Formula C11H13NO2.HCl
  • Boiling Point 331.4 °C at 760 mmHg
  • Molecular Weight 191.22642
  • Flash Point 154.2 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 681448-82-8 (methyl 1,2,3,4-tetrahydroisoquinoline-4-carboxylate)
  • Hazard Symbols
  • Synonyms methyl 1,2,3,4-tetrahydroisoquinoline-4-carboxylate hydrochloride;
  • PSA 38.33000
  • LogP 2.17720

Methyl 1,2,3,4-tetrahydroisoquinoline-4-carboxylate hydrochloride Specification

The cas register number of Methyl 1,2,3,4-tetrahydroisoquinoline-4-carboxylate hydrochloride is 681448-82-8. It also can be called as methyl 1,2,3,4-tetrahydroisoquinoline-4-carboxylate and the Systematic name about this chemical is methyl 1,2,3,4-tetrahydroisoquinoline-4-carboxylate hydrochloride. It belongs to the Chiral chemicals.

Physical properties about Methyl 1,2,3,4-tetrahydroisoquinoline-4-carboxylate hydrochloride are: (1)ACD/LogP: 0.99; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 38.33Å2; (6)Flash Point: 154.2 °C; (7)Enthalpy of Vaporization: 58.54 kJ/mol; (8)Boiling Point: 331.4 °C at 760 mmHg; (9)Vapour Pressure: 0.000113 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.COC(=O)C2CNCc1ccccc12
(2)InChI: InChI=1/C11H13NO2.ClH/c1-14-11(13)10-7-12-6-8-4-2-3-5-9(8)10;/h2-5,10,12H,6-7H2,1H3;1H
(3)InChIKey: CKUUSORWZQEPCN-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C11H13NO2.ClH/c1-14-11(13)10-7-12-6-8-4-2-3-5-9(8)10;/h2-5,10,12H,6-7H2,1H3;1H
(5)Std. InChIKey: CKUUSORWZQEPCN-UHFFFAOYSA-N

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