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Substance Name: Hexcarbacholine bromide [INN]
RN: 306-41-2
UNII: NM87THP11P
InChIKey: AFWBFAMUEOVLFX-UHFFFAOYSA-N

Molecular Formula

  • C18-H40-Br2-N4-O4

Molecular Weight

  • 536.346
 
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Names and Synonyms

Name of Substance

  • Hexacarbacholine bromide
  • Hexcarbacholine bromide [INN]

Synonyms

  • BC 16
  • Bromure d'hexcarbacholine
  • Bromure d'hexcarbacholine [INN-French]
  • Bromuro de hexacarbacolina
  • Bromuro de hexacarbacolina [INN-Spanish]
  • Carbolonium bromide
  • Hexacarbacholini bromidum
  • Hexcarbacholine bromide
  • Hexcarbacholini bromidum
  • Hexcarbacholini bromidum [INN-Latin]
  • Imbretil
  • N,N'-Hexamethylen bis(O-carbamoylcholin)dibromid
  • N,N,N,N',N',N'-Hexamethyl-4,13-dioxo-3,14-dioxa-5,12-diazahexadecamethylendiammonium dibromid
  • UNII-NM87THP11P

Systematic Name

  • Choline bromide hexamethylenedicarbamate

Registry Numbers

CAS Registry Number

  • 306-41-2

FDA UNII

  • NM87THP11P

System Generated Number

  • 0000306412

Structure Descriptors

InChI

1S/C18H38N4O4.2BrH/c1-21(2,3)13-15-25-17(23)19-11-9-7-8-10-12-20-18(24)26-16-14-22(4,5)6;;/h7-16H2,1-6H3;2*1H

InChIKey

AFWBFAMUEOVLFX-UHFFFAOYSA-N

Smiles

C[N+](CCOC(NCCCCCCNC(OCC[N+](C)(C)C)=O)=O)(C)C.[BrH-].[BrH-]

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 175 deg C   EXP
log P (octanol-water) -6.260 (none)   EST
Atmospheric OH Rate Constant 6.83E-11 cm3/molecule-sec 25 EST

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