Triethanolamine - CAS 102-71-6

Catalog:	BB000927
Product Name:	Triethanolamine
CAS:	102-71-6
Synonyms:	Ethanol, 2,2',2''-nitrilotris-; 2,2',2''-Nitrilotris[ethanol]; Ethanol, 2,2',2''-nitrilotri-; 2,2',2''-Nitrilotriethanol; 2-[Bis(2-hydroxyethyl)amino]ethan-1-ol; Alkanolamine 244; Biafine; Daltogen; N,N,N-Tri(2-hydroxyethyl)amine; Nitrilotriethanol; NSC 36718; Rhenofit 3555; S 80 (amine); Sterolamide; Sting-Kill; TEA (amino alcohol); TEA 99; TEA 99LFG; TEOA; TEOA 99; Tri(2-hydroxyethyl)amine; Triethanolamine; Tris(2-hydroxyethyl)amine; Tris(β-hydroxyethyl)amine; tris-(2-Hydroxyethyl)amine; Tris-amino Ultra PC; Trolamine; Trolamine 99NF

Technical Data

Related CAS:	7376-31-0 (x-sulfate)
IUPAC Name:	2-[bis(2-hydroxyethyl)amino]ethanol
Description:	Triethanolamine is a surfactant used as an emulsifier in hand and body lotions, shaving creams, soaps, and shampoos.
Molecular Weight:	149.19
Molecular Formula:	C6H15NO3
Canonical SMILES:	C(CO)N(CCO)CCO
InChI:	InChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2
InChI Key:	GSEJCLTVZPLZKY-UHFFFAOYSA-N
Boiling Point:	335.4°C
Melting Point:	20.5°C
Flash Point:	365 °F
Purity:	≥95%
Density:	1.0985 g/cm3
Solubility:	Soluble in Chloroform (Slightly), Methanol (Slightly)
Appearance:	Pale yellow thick oil to off-white low-melting solid
Storage:	Store at -20°C
Decomposition:	Hazardous decomposition products formed under fire conditions - carbon oxides, Nitrogen oxides (nox)
MDL:	MFCD00002855
LogP:	-1.73470
pH:	10.5 (0.1 N aqueous solution); strong base
Stability:	Stable under recommended storage conditions
Vapor Pressure:	less than 0.01 mmHg at 68 °F ; 10 mmHg at 401 °F

GHS Hazard Statement:	H302 (12.14%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P310, P314, P321, P330, P332+P313, P337+P313, P362, and P501
Signal Word:	Danger

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PMID	Publication Date	Title	Journal
29594315	20180601	Profiling the immunotoxicity of chemicals based on in vitro evaluation by a combination of the Multi-ImmunoTox assay and the IL-8 Luc assay	Archives of toxicology
23696578	20130501	Safety assessment of triethanolamine and triethanolamine-containing ingredients as used in cosmetics	International journal of toxicology
23301495	20130214	Cyanide antidotes for mass casualties: water-soluble salts of the dithiane (sulfanegen) from 3-mercaptopyruvate for intramuscular administration	Journal of medicinal chemistry
23072350	20121105	Heterometallic tetranuclear [Ln(III)2Co(III)2] complexes including suppression of quantum tunneling of magnetization in the [Dy(III)2Co(III)2] single molecule magnet	Inorganic chemistry
22831914	20121101	Kv3 channels modulate calcium signals induced by fast firing patterns in the rat retinal ganglion cells	Cell calcium

Complexity:	55.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	149.10519334
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	149.10519334
Rotatable Bond Count:	6
Topological Polar Surface Area:	63.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1