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Substance Name: Triethylenediamine
RN: 280-57-9
UNII: X8M57R0JS5
InChIKey: IMNIMPAHZVJRPE-UHFFFAOYSA-N

Classification Codes

  • Protective Agents
  • Radiation-Protective Agents
  • Skin / Eye Irritant

Molecular Formula

  • C6-H12-N2

Molecular Weight

  • 112.1748
 
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Names and Synonyms

Results Name

  • Triethylenediamine

Name of Substance

  • 1,4-Diazabicyclo(2.2.2)octane
  • Triethylenediamine

Synonyms

  • 1,4-Diazabicyclo(2.2.2)octane
  • 1,4-Diazabicyclo-octane
  • 1,4-Diazobicyclo(2.2.2)octane
  • 1,4-Ethylenepiperazine
  • AI3-24809
  • Bicyclo(2,2,2)-1,4-diazaoctane
  • CCRIS 6692
  • D 33LV
  • Dabco
  • Dabco 33LV
  • Dabco crystal
  • Dabco EG
  • Dabco R-8020
  • Dabco S-25
  • EC 205-999-9
  • EINECS 205-999-9
  • HSDB 5556
  • N,N'-endo-Ethylenepiperazine
  • NSC 56362
  • TED
  • TEDA
  • Texacat TD 100
  • Thancat TD 33
  • Triethylenediamine
  • UNII-X8M57R0JS5

Systematic Names

  • 1,4-Diazabicyclo(2.2.2)octane
  • 1,4-Diazabicyclooctane
  • Triethylenediamine

Superlist Names

  • 1,4-Diazabicyclo(2.2.2)octane
  • Triethylenediamine

Registry Numbers

CAS Registry Number

  • 280-57-9

FDA UNII

  • X8M57R0JS5

Other Registry Numbers

  • 101484-19-9
  • 150605-01-9
  • 165724-47-0
  • 203072-11-1
  • 23790-33-2
  • 309955-09-7
  • 746642-46-6
  • 88935-43-7
  • 903524-95-8

Related Registry Number

  • 51390-22-8 (diacetate)

System Generated Number

  • 0000280579

Structure Descriptors

InChI

1S/C6H12N2/c1-2-8-5-3-7(1)4-6-8/h1-6H2

InChIKey

IMNIMPAHZVJRPE-UHFFFAOYSA-N

Smiles

N12CCN(CC1)CC2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 2250mg/kg (2250mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: MUSCLE WEAKNESS
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 45(5), Pg. 67, 1980.
rabbit LD50 oral 1100mg/kg (1100mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 45(5), Pg. 67, 1980.
rat LD50 oral 1700mg/kg (1700mg/kg)   Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete. Vol. 20, Pg. 393, 1974.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 159 deg C   EXP
Boiling Point 174 deg C   EXP
pKa Dissociation Constant 8.82 (none)   EXP
log P (octanol-water) -0.490 (none)   EST
Water Solubility 4.50E+05 mg/L 25 EXP
Henry's Law Constant 4.67E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.20E-11 cm3/molecule-sec 25 EXP

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