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Substance Name: Dimethylethylenediamine
RN: 110-70-3
InChIKey: KVKFRMCSXWQSNT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C4-H12-N2

Molecular Weight

  • 88.1528
 
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Names and Synonyms

Name of Substance

  • Dimethylethylenediamine

Synonyms

  • 1,2-Bis(methylamino)ethane
  • 2,5-Diazahexane
  • 4-04-00-01171 (Beilstein Handbook Reference)
  • AI3-26668
  • BRN 0878142
  • EINECS 203-793-3
  • N,N'-Dimethyl-1,2-ethanediamine
  • N,N'-Dimethyldiaminoethane
  • N,N'-Dimethylethanediamine
  • N,N'-Dimethylethylenediamine
  • sym-Dimethylethylenediamine

Systematic Names

  • 1,2-Ethanediamine, N,N'-dimethyl-
  • 1,2-Ethanediamine, N1,N2-dimethyl-
  • Ethylenediamine, N,N'-dimethyl-
  • N,N'-Dimethylethylenediamine

Registry Numbers

CAS Registry Number

  • 110-70-3

System Generated Number

  • 0000110703

Structure Descriptors

InChI

1S/C4H12N2/c1-5-3-4-6-2/h5-6H,3-4H2,1-2H3

InChIKey

KVKFRMCSXWQSNT-UHFFFAOYSA-N

Smiles

C(CNC)NC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 17, Pg. 235, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 120 deg C   EXP
pKa Dissociation Constant 10.16 (none) 25 EXP
log P (octanol-water) -0.62 (none)   EXP
Water Solubility 1.00E+06 mg/L 25 EST
Vapor Pressure 20.6 mm Hg 25 EST
Henry's Law Constant 4.99E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.50E-10 cm3/molecule-sec 25 EST

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