Product Name

  • Name

    (5alpha,6alpha)-17,17-dimethyl-7,8-didehydro-4,5-epoxymorphinan-17-ium-3,6-diol chloride

  • EINECS
  • CAS No. 14075-02-6
  • Density
  • Solubility
  • Melting Point
  • Formula C18H22 N O3 . Cl
  • Boiling Point
  • Molecular Weight 335.86
  • Flash Point
  • Transport Information
  • Appearance
  • Safety Poison by intravenous and subcutaneous routes. Moderately toxic by parenteral route. When heated to decomposition it emits very toxic fumes of NOx and Cl−. See also (−)-MORPHINE.
  • Risk Codes
  • Molecular Structure Molecular Structure of 14075-02-6 ((5alpha,6alpha)-17,17-dimethyl-7,8-didehydro-4,5-epoxymorphinan-17-ium-3,6-diol chloride)
  • Hazard Symbols
  • Synonyms Morphinanium,7,8-didehydro-4,5a-epoxy-3,6a-dihydroxy-17,17-dimethyl-,chloride (8CI); Morphine methylchloride; N-Methylmorphine chloride;N-Methylmorphinium chloride
  • PSA
  • LogP

Morphine methylchloride Chemical Properties

Molecule structure of Morphine methylchloride (CAS NO.14075-02-6):

Molecular Weight: 335.82518 g/mol
Molecular Formula: C18H22ClNO3
H-Bond Donor: 2
H-Bond Acceptor: 4
Tautomer Count: 2
Exact Mass: 335.128821
MonoIsotopic Mass: 335.128821
Topological Polar Surface Area: 49.7
Heavy Atom Count: 23
Complexity: 532 
Defined Atom StereoCenter Count: 5 
Canonical SMILES: C[N+]1(CCC23C4C1CC5=C2C(=C(C=C5)O)OC3C(C=C4)O)C.[Cl-]
Isomeric SMILES: C[N+]1(CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O)C.[Cl-]
InChI: InChI=1S/C18H21NO3.ClH/c1-19(2)8-7-18-11-4-6-14(21)17(18)22-16-13(20)5-3-10(15(16)18)9-12(11)19;/h3-6,11-12,14,17,21H,7-9H2,1-2H3;1H/t11-,12+,14-,17-,18-;/m0./s1
InChIKey of Morphine methylchloride (CAS NO.14075-02-6): MJNCZWBHCFTYFU-SCLAZZCHSA-N

Morphine methylchloride Toxicity Data With Reference

1.    

scu-mus LDLo:271 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 49 (1933),319.
2.    

ivn-mus LD50:32,700 µg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 157 (1967),185.
3.    

scu-rbt LDLo:172 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 49 (1933),319.
4.    

par-frg LDLo:2500 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 49 (1933),319.

Morphine methylchloride Safety Profile

Poison by intravenous and subcutaneous routes. Moderately toxic by parenteral route. When heated to decomposition it emits very toxic fumes of NOx and Cl−. See also (−)-MORPHINE.

Morphine methylchloride Specification

 Morphine methylchloride (CAS NO.14075-02-6) is also named as 7,8-Didehydro-4,5-epoxy-3,6-dihydroxy-17,17-dimethylmorphinanium chloride, (5alpha,6alpha)- ; Morphinan-3,6-alpha-diol, 7,8-didehydro-4,5-alpha-epoxy-17-methyl-, methochloride ; Morphinanium, 7,8-didehydro-4,5-alpha-epoxy-3,6-alpha-dihydroxy-17,17-dimethyl-, chloride ; N-Methyl morphine chloride ; N-Methylmorphinium chloride ; Morphinanium, 7,8-didehydro-3,6-dihydroxy-17,17-dimethyl-4,5-epoxy-, chloride ; Morphinanium, 7,8-didehydro-4,5-epoxy-3,6-dihydroxy-17,17-dimethyl-, chloride, (5alpha,6alpha)- .

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