Triethanolamine hydrochloride - CP, ≥97% , CAS No.637-39-8

CAS: 637-39-8 Cat. No.: T103911 Molecular Weight: 185.65 Beilstein Registry Number: 3909940 EC Number: 211-284-2 PubChem CID: 101814

GRADE & PURITY CP, ≥97%

Synonyms

2-[bis(2-hydroxyethyl)amino]ethan-1-ol hydrochloride | E77610 | MS-25753 | R297UJ9QDY | Triethanolamine hydrochloride | AKOS015915974 | Gold etchant, standard | TEA-HYDROCHLORIDE [INCI] | 2,2',2''-Nitrilotriethanol hydrochloride | Tris(2-hydroxyethyl)amin

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

Synonyms

2-[bis(2-hydroxyethyl)amino]ethan-1-ol hydrochloride | E77610 | MS-25753 | R297UJ9QDY | Triethanolamine hydrochloride | AKOS015915974 | Gold etchant, standard | TEA-HYDROCHLORIDE [INCI] | 2, 2', 2''-Nitrilotriethanol hydrochloride | Tris(2-hydroxyethyl)amin

Specifications & Purity

CP, ≥97%

Storage

Protected from light, Room temperature

Shipped In

Normal

Grade

CP

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C(CO)N(CCO)CCO.Cl
• IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol;hydrochloride
• InChIKey: HHLJUSLZGFYWKW-UHFFFAOYSA-N
• INCHI: 1S/C6H15NO3.ClH/c8-4-1-7(2-5-9)3-6-10;/h8-10H,1-6H2;1H
• Isomeric SMILES: C(CO)N(CCO)CCO.Cl
• WGK Germany: 1
• RTECS: KL9346500
• PubChem CID: 101814
• Molecular Weight: 185.65
• Beilstein: 3909940

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Alkanolamines
          • Level6 1,2-aminoalcohols

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Alkanolamines
• Direct Parent: 1,2-aminoalcohols
• Alternative Parents: Trialkylamines Primary alcohols Organopnictogen compounds Organic zwitterions Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tertiary aliphatic amine - Tertiary amine - 1,2-aminoalcohol - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organic zwitterion - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as 1,2-aminoalcohols. These are organic compounds containing an alkyl chain with an amine group bound to the C1 atom and an alcohol group bound to the C2 atom.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: Light sensitive.moisture sensitive
• Melt Point(°C): 177°C
• Molecular Weight: 185.650 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 185.082 Da
• Monoisotopic Mass: 185.082 Da
• Topological Polar Surface Area: 63.900 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 55.700
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

References

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