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Substance Name: Piperidinium, 1,1'-(p,p'-biphenylylenebis(3-methyl-2-butenylene))bis(1-carboxymethyl-, dichloride, dibutyl ester
RN: 55618-69-4
InChIKey: XVUGJXWVLJBVMP-IAMMTMLTSA-L

Molecular Formula

  • C44-H66-N2-O4.2Cl

Molecular Weight

  • 757.9214
 
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Names and Synonyms

  • Piperidinium, 1,1'-(p,p'-biphenylylenebis(3-methyl-2-butenylene))bis(1-carboxymethyl-, dichloride, dibutyl ester

Registry Numbers

CAS Registry Number

  • 55618-69-4

System Generated Number

  • 0055618694

Molecular Formulas

Molecular Formula

  • C44-H66-N2-O4.2Cl

Molecular Formula Fragments

  • C44-H66-N2-O4
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C44H66N2O4.2ClH/c1-5-7-31-49-43(47)35-45(25-11-9-12-26-45)29-23-37(3)33-39-15-19-41(20-16-39)42-21-17-40(18-22-42)34-38(4)24-30-46(27-13-10-14-28-46)36-44(48)50-32-8-6-2;;/h15-24H,5-14,25-36H2,1-4H3;2*1H/q+2;;/p-2/b37-23+,38-24+;;

InChIKey

XVUGJXWVLJBVMP-IAMMTMLTSA-L

Smiles

CCCCOC(=O)C[N+]1(CCCCC1)C/C=C(/Cc2ccc(cc2)c3ccc(cc3)C/C(=C/C[N+]4(CCCCC4)CC(=O)OCCCC)/C)\C.[Cl-].[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 20mg/kg (20mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.
rat LD50 intraperitoneal 20mg/kg (20mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.