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Substance Name: Hedaquinium chloride [INN:BAN]
RN: 4310-89-8
UNII: VKH4J07Q4K
InChIKey: KZUZUJNAVUAVOW-UHFFFAOYSA-L

Molecular Formula

  • C34-H46-N2.2Cl

Molecular Weight

  • 553.657
 
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Names and Synonyms

Name of Substance

  • Hedaquinium chloride [INN:BAN]

Synonyms

  • 2,2'-Hexadecamethylenebis(isoquinolinium chloride)
  • B1Q 16
  • BIQ 16
  • Chlorure d'hedaquinium
  • Chlorure d'hedaquinium [INN-French]
  • Cloruro de hedaquinio
  • Cloruro de hedaquinio [INN-Spanish]
  • EINECS 224-325-4
  • Hedaquinii chloridum
  • Hedaquinii chloridum [INN-Latin]
  • Hedaquinium chloride
  • Hexadecane-1,16-bis-isoquinolinium chloride
  • Isoquinolinium, 2,2'-(1,16-hexadecadecanediyl)bis-, dichloride
  • Teoquil
  • Teoquil chloride
  • UNII-VKH4J07Q4K
  • USAF XR-39

Systematic Names

  • 2,2'-Hexadecamethylenebis(isoquinolinium chloride)
  • Hedaquinium chloride
  • Isoquinolinium, 2,2'-hexadecamethylenebis-, dichloride

Registry Numbers

CAS Registry Number

  • 4310-89-8

FDA UNII

  • VKH4J07Q4K

System Generated Number

  • 0004310898

Molecular Formulas

Molecular Formula

  • C34-H46-N2.2Cl

Molecular Formula Fragments

  • C34-H46-N2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C34H46N2.2ClH/c1(3-5-7-9-11-17-25-35-27-23-31-19-13-15-21-33(31)29-35)2-4-6-8-10-12-18-26-36-28-24-32-20-14-16-22-34(32)30-36;;/h13-16,19-24,27-30H,1-12,17-18,25-26H2;2*1H/q+2;;/p-2

InChIKey

KZUZUJNAVUAVOW-UHFFFAOYSA-L

Smiles

c12c(c[n+](CCCCCCCCCCCCCCCC[n+]3cc4c(cccc4)cc3)cc1)cccc2.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 10mg/kg (10mg/kg)   National Technical Information Service. Vol. AD277-689,