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Diisopropanolamine

CAT: 0572-TRC-D447000-250GSize: 250 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D447000-250GSize:250 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
110-97-4
Synonyms
2-Propanol, 1,1'-iminodi- (6CI,7CI,8CI); 1,1'-Iminobis[2-propanol]; 1,1'-Iminodi-2-propanol; 1-(2-Hydroxypropylamino)propan-2-ol; 1-[(2-Hydroxypropyl)amino]propan-2-ol; Bis(2-hydroxypropyl)amine; Bis(2-propanol)amine; DIPA; DIPA (alcohol); Di-2-propanolamine; Diisopropanolamine; N,N-Bis(2-hydroxypropyl)amine; N,N-Diisopropanolamine; NSC 4963
Hazard Statement
Causes serious eye irritation
Purity
>95% (GC)
Smiles
CC(O)CNCC(C)O
Molecular Formula
C6 H15 N O2
Molecular Weight
133.189
InChI
InChI=1S/C6H15NO2/c1-5(8)3-7-4-6(2)9/h5-9H,3-4H2,1-2H3
Additionnal Information
IUPAC name: 1-(2-hydroxypropylamino)propan-2-ol
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Diisopropanolamine

Diisopropanolamine is a secondary amino compound that is diethanolamine substituted by methyl groups at positions 1 and 1'. It is a versatile chemical used in a variety of personal care, cosmetic and industrial products. It has a role as a surfactant, a buffer and an emulsifier. It is an aminodiol, a secondary alcohol and a secondary amino compound. It is functionally related to a 1-aminopropan-2-ol.

CAS Number110-97-4
PubChem CID8086
IUPAC Name1-(2-hydroxypropylamino)propan-2-ol
Molecular FormulaC6H15NO2
Molecular Weight133.19
XLogP-0.8
Topological Polar Surface Area52.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count9
Formal Charge0
Complexity60
SMILES
CC(CNCC(C)O)O
InChI
InChI=1S/C6H15NO2/c1-5(8)3-7-4-6(2)9/h5-9H,3-4H2,1-2H3
InChIKey
LVTYICIALWPMFW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diisopropanolamine
CAS: 110-97-4
CID: 8086
Formula: C6H15NO2
MW: 133.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight133.19
XLogP3-0.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass133.110278721
Monoisotopic Mass133.110278721
Topological Polar Surface Area52.5 Ų
Heavy Atom Count9
Formal Charge0
Complexity60.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
14001-02Diisopropanolamine
D32380Diisopropanolamine 98%
B28510N-Butyl diisopropanolamine
274457-01Diisopropanolamine discontinued. See 447056
D32375-01Diisopropanolamine sum of isomers 98%
24465-01Diisopropanolamine (DIPOA) extrapure AR, 98%

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