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Substance Name: Piperidinium, 1,1'-(p,p'-biphenylylenebis(3-methyl-2-butenylene))bis(1-carboxymethyl-, dichloride, diethyl ester
RN: 55618-67-2
InChIKey: GCHXNDKUFJYALW-WPBGZSBXSA-L

Molecular Formula

  • C40-H58-N2-O4.2Cl

Molecular Weight

  • 701.8142
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 55618-67-2

System Generated Number

  • 0055618672

Molecular Formulas

Molecular Formula

  • C40-H58-N2-O4.2Cl

Molecular Formula Fragments

  • C40-H58-N2-O4
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C40H58N2O4.2ClH/c1-5-45-39(43)31-41(23-9-7-10-24-41)27-21-33(3)29-35-13-17-37(18-14-35)38-19-15-36(16-20-38)30-34(4)22-28-42(25-11-8-12-26-42)32-40(44)46-6-2;;/h13-22H,5-12,23-32H2,1-4H3;2*1H/q+2;;/p-2/b33-21+,34-22+;;

InChIKey

GCHXNDKUFJYALW-WPBGZSBXSA-L

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 6700ug/kg (6.7mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.
rat LD50 intraperitoneal 6700ug/kg (6.7mg/kg)   Russian Pharmacology and Toxicology Vol. 40, Pg. 69, 1977.