N~4~-(6-Methoxy-8-quinolinyl)-1,4-pentanediamine phosphate (1:2) | CAS No. 63-45-6

N~4~-(6-Methoxy-8-quinolinyl)-1,4-pentanediamine phosphate (1:2)

Basic Information

CAS Number

63-45-6

Molecular Formula

C15H27N3O9P2

Molecular Weight

455.34 g/mol

AD

Basic Physical Properties

Melting Point

205-206 °C (dec.)

Boiling Point

451.1°C at 760 mmHg

Flash Point

226.6°C

Solubility

water: soluble50mg/mL, clear, orange to red

CC(CCCN)NC1=C2C(=CC(=C1)OC)C=CC=N2.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/C15H21N3O.2H3O4P/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14;2*1-5(2,3)4/h4,6,8-11,18H,3,5,7,16H2,1-2H3;2*(H3,1,2,3,4)

InChIKey

GJOHLWZHWQUKAU-UHFFFAOYSA-N

LogP

0.9255000000000004

Topological Polar Surface Area

215.68999999999997 Ų

Hydrogen Bond Donor/Acceptor

9 / 12

Complexity

312

Safety Information

View Safety Information

GHS Hazard Pictograms

H301H301

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

  • Primaquine phosphate;Primaquine bisphosphate
  • NCGC00094767-01
  • SR-05000001864
  • Primaquine phosphate, United States Pharmacopeia (USP) Reference Standard
  • Tox21_110350_1
  • Primaquini diphosphas
  • E75742
  • AKOS026749962
  • HMS502I08
  • 1,4-Pentanediamine, N(4)-(6-methoxy-8-quinolinyl)-, phosphate (1:2)
  • 8-?(4-?Amino-?1-?methylbutylamino)?-?6-?methoxyquinoline diphosphate salt
  • 1,4-Pentanediamine, N4-(6-methoxy-8-quinolinyl)-, phosphate (1:2)
  • primaquinbis(phosphat)
  • HMS1920J18
  • CCRIS 1946
  • HY-12651
  • H0982HF78B
  • 8-((4-Amino-1-methylbutyl)amino)-6-methoxyquinoline diphosphate
  • CAS-63-45-6
  • 8-(4-Amino-1-methylbutylamino)-6-methoxyquinoline diphosphate
  • PRIMACHINE PHOSPHATE
  • HMS2096O14
  • EN300-119547
  • EINECS 200-560-8
  • Primaquine phosphate (JAN/USP)
  • Primaquine (TN)
  • NCGC00178754-06
  • 8-(4-Amino-1-methylbutylamino)-6-methoxyquinolinediphosphate
  • N4-(6-methoxyquinolin-8-yl)pentane-1,4-diaminebis(phosphate)
  • 1,4-Pentanediamine, N4-(6-methoxy-8-quinolinyl)-, phosphate(1:2)
  • primaquine diphosphate

MDL Number

MFCD00013166

Customs Code

2933499090

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