Product Name

  • Name

    NEOANTERGAN PHOSPHATE

  • EINECS
  • CAS No. 63681-05-0
  • Density g/cm3
  • Solubility
  • Melting Point
  • Formula C17H23N3O•H3O4P
  • Boiling Point 423.8°Cat760mmHg
  • Molecular Weight 383.43
  • Flash Point 210.1°C
  • Transport Information
  • Appearance
  • Safety Poison by intravenous, intraperitoneal, and subcutaneous routes. When heated to decomposition it emits very toxic fumes of POx and NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 63681-05-0 (NEOANTERGAN PHOSPHATE )
  • Hazard Symbols
  • Synonyms
  • PSA
  • LogP

Neoantergan phosphate Chemical Properties

Molecule structure of Neoantergan phosphate (CAS NO.63681-05-0):

IUPAC Name: N-[(4-Methoxyphenyl)methyl]-N',N'-dimethyl-N-pyridin-2-ylethane-1,2-diamine; phosphoric acid 
Molecular Weight: 383.379201 g/mol
Molecular Formula: C17H26N3O5P 
Boiling Point: 423.8 °C at 760 mmHg
Flash Point: 210.1 °C
Enthalpy of Vaporization: 67.82 kJ/mol
Vapour Pressure: 2.17E-07 mmHg at 25 °C
H-Bond Donor: 3
H-Bond Acceptor: 8
Rotatable Bond Count: 7
Exact Mass: 383.161007
MonoIsotopic Mass: 383.161007
Topological Polar Surface Area: 106
Heavy Atom Count: 26
Complexity: 327
Canonical SMILES: CN(C)CCN(CC1=CC=C(C=C1)OC)C2=CC=CC=N2.OP(=O)(O)O
InChI: InChI=1S/C17H23N3O.H3O4P/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15;1-5(2,3)4/h4-11H,12-14H2,1-3H3;(H3,1,2,3,4)
InChIKey of Neoantergan phosphate (CAS NO.63681-05-0): GDOTWPAJJGIXFK-UHFFFAOYSA-N

Neoantergan phosphate Toxicity Data With Reference

1.    

ipr-mus LD50:90 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 89 (1947),247.
2.    

scu-mus LD50:150 mg/kg

     PHREA7    Physiological Reviews. 27 (1947),542.
3.    

ivn-mus LD50:30 mg/kg

     PHREA7    Physiological Reviews. 27 (1947),542.
4.    

scu-gpg LD50:70 mg/kg

     PHREA7    Physiological Reviews. 27 (1947),542.

Neoantergan phosphate Safety Profile

Poison by intravenous, intraperitoneal, and subcutaneous routes. When heated to decomposition it emits very toxic fumes of POx and NOx.

Neoantergan phosphate Specification

 Neoantergan phosphate (CAS NO.63681-05-0) is also named as 2786 R.P. phosphate ; N-alpha-Pyridyl-N-p-methoxybenzyl-N',N'-dimethylethylenediamine phosphate ; N-p-Methoxybenzyl-N-dimethylaminoethyl alpha-aminopyridine
Pyridine, 2-((2-(dimethylamino)ethyl)(p-methoxybenzyl)amino)-, phosphate .

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