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Substance Name: Dihydroxypropyltrimonium chloride
RN: 34004-36-9
UNII: V5RP514IX5
InChIKey: YSRQRFIVCMIJJE-UHFFFAOYSA-M

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C6-H16-N-O2.Cl

Molecular Weight

  • 169.65
 
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Names and Synonyms

Name of Substance

  • Dihydroxypropyltrimonium chloride

Synonyms

  • (2,3-Dihydroxypropyl)trimethylammonium chloride
  • 1-Propanaminium, 2,3-dihydroxy-N,N,N-trimethyl-, chloride
  • EINECS 251-783-2
  • UNII-V5RP514IX5

Systematic Names

  • (2,3-Dihydroxypropyl)trimethylammonium chloride
  • 1-Propanaminium, 2,3-dihydroxy-N,N,N-trimethyl-, chloride
  • 1-Propanaminium, 2,3-dihydroxy-N,N,N-trimethyl-, chloride (1:1)
  • Ammonium, (2,3-dihydroxypropyl)trimethyl-, chloride

Registry Numbers

CAS Registry Number

  • 34004-36-9

FDA UNII

  • V5RP514IX5

Other Registry Number

  • 1883418-77-6

System Generated Number

  • 0034004369

Molecular Formulas

Molecular Formula

  • C6-H16-N-O2.Cl

Molecular Formula Fragments

  • C6-H16-N-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C6H16NO2.ClH/c1-7(2,3)4-6(9)5-8;/h6,8-9H,4-5H2,1-3H3;1H/q+1;/p-1

InChIKey

YSRQRFIVCMIJJE-UHFFFAOYSA-M

Smiles

C([C@@H](CO)O)[N+](C)(C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 1700ug/kg (1.7mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 6, Pg. 477, 1914/1915.