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Substance Name: Diisopropanolamine [NF]
RN: 110-97-4
UNII: 0W44HYL8T5
InChIKey: LVTYICIALWPMFW-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C6-H15-N-O2

Molecular Weight

  • 133.189
 
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Names and Synonyms

Name of Substance

  • 1,1'-Iminobis-2-propanol
  • 2-Propanol, 1,1'-iminobis-
  • Diisopropanolamine
  • Diisopropanolamine [NF]
  • DIPA

Synonyms

  • 1,1'-Iminobis-2-propanol
  • 1,1'-Iminodi-2-propanol
  • 3-04-00-00761 (Beilstein Handbook Reference)
  • Bis(2-hydroxypropyl)amine
  • Bis(2-propanol)amine
  • BRN 0605363
  • CCRIS 6234
  • Di-2-propanolamine
  • Diisopropanolamine
  • DIPA
  • DIPA (alcohol)
  • Dipropyl-2,2'-dihydroxy-amine
  • EC 203-820-9
  • EINECS 203-820-9
  • HSDB 338
  • N,N-Bis(2-hydroxypropyl)amine
  • NSC 4963
  • UNII-0W44HYL8T5

Systematic Names

  • 1,1'-Iminodipropan-2-ol
  • 2-Propanol, 1,1'-iminobis-
  • 2-Propanol, 1,1'-iminodi-
  • Diisopropanolamine

Superlist Names

  • 2-Propanol, 1,1'-iminobis-
  • 2-Propanol, 1,1'-iminodi-
  • Diisopropanolamine

Registry Numbers

CAS Registry Number

  • 110-97-4

FDA UNII

  • 0W44HYL8T5

Other Registry Numbers

  • 1141787-00-9
  • 1335-54-2

System Generated Number

  • 0000110974

Structure Descriptors

InChI

1S/C6H15NO2/c1-5(8)3-7-4-6(2)9/h5-9H,3-4H2,1-2H3

InChIKey

LVTYICIALWPMFW-UHFFFAOYSA-N

Smiles

C([C@@H](C)O)NC[C@@H](C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 skin > 1gm/kg (1000mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(7), Pg. 46, 1986.
mouse LD50 intraperitoneal 96mg/kg (96mg/kg) AUTONOMIC NERVOUS SYSTEM: BETA ADRENERGIC BLOCKAGE Ain Shams Medical Journal. Vol. 30, Pg. 23, 1979.
rat LD50 oral 4765mg/kg (4765mg/kg) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 30(7), Pg. 46, 1986.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 44.5 deg C   EXP
Boiling Point 250 deg C   EXP
pKa Dissociation Constant 9.1 (none)   EXP
log P (octanol-water) -0.82 (none)   EXP
Water Solubility 8.70E+05 mg/L 25 EXP
Henry's Law Constant 6.91E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.02E-10 cm3/molecule-sec 25 EST

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