N-Lauryldiethanolamine - ≥95% , CAS No.1541-67-9

CAS: 1541-67-9 Cat. No.: N159694 Molecular Weight: 273.46 Beilstein Registry Number: 4(3)695 EC Number: 216-277-8

GRADE & PURITY ≥95%

Synonyms

EINECS 216-277-8 | n-Dodecylbis(hydroxyethyl)amine | Bis(2-hydroxyethyl) Lauryl Amine | Ethanol,2,2'-(dodecylimino)bis- | AC-11753 | BAA54167 | Dodecylbis(hydroxyethyl)amine | (2R)-2-{[(Benzyloxy)carbonyl]amino}-3-methylbutanoic acid, AldrichCPR

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

EINECS 216-277-8 | n-Dodecylbis(hydroxyethyl)amine | Bis(2-hydroxyethyl) Lauryl Amine | Ethanol, 2, 2'-(dodecylimino)bis- | AC-11753 | BAA54167 | Dodecylbis(hydroxyethyl)amine | (2R)-2-{[(Benzyloxy)carbonyl]amino}-3-methylbutanoic acid, AldrichCPR

Specifications & Purity

≥95%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

INHIBITOR

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 504758571
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504758571
• Canonical Smiles: CCCCCCCCCCCCN(CCO)CCO
• IUPAC Name: 2-[dodecyl(2-hydroxyethyl)amino]ethanol
• InChIKey: NKFNBVMJTSYZDV-UHFFFAOYSA-N
• INCHI: 1S/C16H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-17(13-15-18)14-16-19/h18-19H,2-16H2,1H3
• Isomeric SMILES: CCCCCCCCCCCCN(CCO)CCO
• Molecular Weight: 273.46
• Beilstein: 4(3)695
• Reaxy-Rn: 1765726
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1765726&ln=

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 Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tertiary aliphatic amine - Tertiary amine - 1,2-aminoalcohol - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - 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: air sensitive
• Refractive Index: 1.47
• Flash Point(°C): 171 °C
• Boil Point(°C): 195 °C/3 mmHg
• Molecular Weight: 273.450 g/mol
• XLogP3: 4.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 15
• Exact Mass: 273.267 Da
• Monoisotopic Mass: 273.267 Da
• Topological Polar Surface Area: 43.700 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 159.000
• 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: 1

References

1. Feifei Luo, Mengmeng Hao, Lei Zhang, Yangguo Xie, Wei Hou, Hongya Wang, Zhongli Zhang.  (2023)  Identification of nonvolatile organic compounds (NVOCs) in biopharmaceuticals through non-target analysis and quantification using complexation-precipitation extraction.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:38039624] [10.1016/j.chroma.2023.464540]

2. Lingfeng Hu, Xueyuan Zhai, Jinge Li, Xiaoniu Yang, Mingbo Ruan.  (2023)  Improving the Mechanical Properties and Tribological Behavior of Sulfobetaine Polyurethane Based on Hydrophobic Chains to Be Applied as Artificial Meniscus.  ACS Applied Materials & Interfaces,      [PMID:37306556] [10.1021/acsami.3c02940]

3. Lingfeng Hu, Jinge Li, Xiaoniu Yang, Mingbo Ruan.  (2024)  A Common Hydration Lubrication Based on Hydrophobically Modified Sulfobetaine Polyurethane and Synovial Components in the Application of Artificial Meniscus.  CHEMISTRY OF MATERIALS,      [PMID:] [10.1021/acs.chemmater.4c01331]