Molecule structure of Dihydromorphine hydrochloride (CAS NO.1421-28-9) :
Molecular Weight: 323.81448 g/mol
Molecular Formula: C17H22ClNO3
Boiling Point: 475.4 °C at 760 mmHg
Flash Point: 241.3 °C
Enthalpy of Vaporization: 77.83 kJ/mol
Vapour Pressure: 7.65E-10 mmHg at 25 °C
H-Bond Donor: 3
H-Bond Acceptor: 4
Tautomer Count: 3
Exact Mass: 323.128821
MonoIsotopic Mass: 323.128821
Topological Polar Surface Area: 52.9
Heavy Atom Count: 22
Complexity: 457
Defined Atom StereoCenter Count: 5
Canonical SMILES: CN1CCC23C4C1CC5=C2C(=C(C=C5)O)OC3C(CC4)O.Cl
Isomeric SMILES: CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](CC4)O.Cl
InChI: InChI=1S/C17H21NO3.ClH/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18;/h2,4,10-11,13,16,19-20H,3,5-8H2,1H3;1H/t10-,11+,13-,16-,17-;/m0./s1
InChIKey of Dihydromorphine hydrochloride (CAS NO.1421-28-9) : DZGJPYLWWJSNCT-VYKNHSEDSA-N
1. | scu-mus LDLo:149 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 52 (1934),468. | ||
2. | ivn-mus LD50:55 mg/kg | TXAPA9 Toxicology and Applied Pharmacology. 6 (1964),334. | ||
3. | orl-rbt LDLo:800 mg/kg | HBAMAK “Abdernaldens Handbuch der Biologischen Arbeitsmethoden.“ 4 (1935),1289. | ||
4. | scu-rbt LD50:50 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 66 (1939),182. | ||
5. | par-rbt LDLo:142 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 66 (1939),182. | ||
6. | scu-gpg LDLo:500 mg/kg | HBAMAK “Abdernaldens Handbuch der Biologischen Arbeitsmethoden.“ 4 (1935),1289. |
Poison by subcutaneous, intravenous, and parenteral routes. Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NOx and HCl. See also (−)-MORPHINE.
Dihydromorphine hydrochloride (CAS NO.1421-28-9) is also called Morphinan-3,6-diol, 4,5-epoxy-17-methyl-, hydrochloride, (5-alpha,6-alpha)- ; Morphine, dihydro-, hydrochloride ; NSC 404353 ; Morphinan-3,6-diol, 4,5-epoxy-17-methyl-, hydrochloride, (5alpha,6alpha)- (9CI) ; Morphinan-3,6alpha-diol, 4,5-alpha-epoxy-17-methyl-, hydrochloride ; Morphinan-3,6alpha-diol, 4,5alpha-epoxy-17-methyl-, hydrochloride (8CI) ; Morphine, dihydro-, hydrochloride .
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