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Substance Name: Ethanol, 2-(bis(1-methylethyl)amino)-
RN: 96-80-0
InChIKey: ZYWUVGFIXPNBDL-UHFFFAOYSA-N

Note

  • A binary chemical munition destruction product.

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C8-H19-N-O

Molecular Weight

  • 145.244
 
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Names and Synonyms

Synonyms

  • (Diisopropylamino)ethanol
  • (N,N-Diisopropylamino)ethanol
  • 2-(Diisopropylamino)ethyl alcohol
  • 2-Diisopropylaminoethanol
  • 4-04-00-01504 (Beilstein Handbook Reference)
  • AI3-26461
  • BRN 1697955
  • Diisopropyl ethanolamine
  • Diisopropylethanolamine
  • EINECS 202-536-2
  • N,N-Diisopropylethanolamine
  • NSC 45475

Systematic Names

  • 2-Diisopropylaminoethanol
  • Ethanol, 2-(bis(1-methylethyl)amino)-
  • Ethanol, 2-(diisopropylamino)-

Superlist Name

  • N,N-Diisopropyl ethanolamine

Registry Numbers

CAS Registry Number

  • 96-80-0

System Generated Number

  • 0000096800

Structure Descriptors

InChI

1S/C8H19NO/c1-7(2)9(5-6-10)8(3)4/h7-8,10H,5-6H2,1-4H3

InChIKey

ZYWUVGFIXPNBDL-UHFFFAOYSA-N

Smiles

N(CCO)(C(C)C)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LC50 inhalation 1661mg/m3/6H (1661mg/m3)   Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 216, 1992.
mouse LD50 oral 770mg/kg (770mg/kg)   Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 216, 1992.
rabbit LD50 skin 450uL/kg (0.45mL/kg)   AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.
rat LC50 inhalation 1965mg/m3/6H (1965mg/m3)   Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 216, 1992.
rat LD50 oral 860mg/kg (860mg/kg)   Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 216, 1992.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -3.90E+01 deg C   EXP
Boiling Point 190 deg C   EXP
pKa Dissociation Constant 10.08 (none) 20 EXP
log P (octanol-water) 0.880 (none)   EST
Water Solubility 1.20E+04 mg/L 25 EXP
Vapor Pressure 0.08 mm Hg 20 EXP
Henry's Law Constant 1.27E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.18E-10 cm3/molecule-sec 25 EST

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