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Substance Name: Halimide
RN: 19014-05-2
UNII: 66P6Q8243E
InChIKey: YGKOYVNJPRSSRX-UHFFFAOYSA-M

Molecular Formula

  • C22-H40-N.Cl

Molecular Weight

  • 354.018
 
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Names and Synonyms

Name of Substance

  • Halimide

Synonyms

  • EINECS 242-754-5
  • UNII-66P6Q8243E

Systematic Names

  • 4-Dodecylbenzyltrimethylammonium chloride
  • Benzenemethanaminium, 4-dodecyl-N,N,N-trimethyl-, chloride
  • Benzenemethanaminium, 4-dodecyl-N,N,N-trimethyl-, chloride (1:1)

Registry Numbers

CAS Registry Number

  • 19014-05-2

FDA UNII

  • 66P6Q8243E

Other Registry Number

  • 39392-90-0

System Generated Number

  • 0019014052

Molecular Formulas

Molecular Formula

  • C22-H40-N.Cl

Molecular Formula Fragments

  • C22-H40-N
  • Cl
  • COMPONENT

Structure Descriptors

InChI

InChI=1S/C22H40N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-21-16-18-22(19-17-21)20-23(2,3)4;/h16-19H,5-15,20H2,1-4H3;1H/q+1;/p-1

InChIKey

YGKOYVNJPRSSRX-UHFFFAOYSA-M

Smiles

[Cl-].CCCCCCCCCCCCc1ccc(C[N+](C)(C)C)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.480 (none)   EST
Atmospheric OH Rate Constant 3.36E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.