2,2,6,6-Tetramethyl-4-piperidinyl stearate - ≥96%, Mixture of C16 & C18 , CAS No.167078-06-0

CAS: 167078-06-0 Cat. No.: T305124 Molecular Weight: 423.72 EC Number: 605-462-2 PubChem CID: 14113416

GRADE & PURITY ≥96%, Mixture of C16 & C18

Synonyms

167078-06-0|2,2,6,6-Tetramethyl-4-piperidinyl stearate|24860-22-8|(2,2,6,6-tetramethylpiperidin-4-yl) octadecanoate|2,2,6,6-tetramethylpiperidin-4-yl stearate|Light Stabilizer 3853|SCHEMBL226443|JMUOXOJMXILBTE-UHFFFAOYSA-N|DTXSID801337919|AKOS015895797|FT

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

167078-06-0 | 2, 2, 6, 6-Tetramethyl-4-piperidinyl stearate | 24860-22-8 | (2, 2, 6, 6-tetramethylpiperidin-4-yl) octadecanoate | 2, 2, 6, 6-tetramethylpiperidin-4-yl stearate | Light Stabilizer 3853 | SCHEMBL226443 | JMUOXOJMXILBTE-UHFFFAOYSA-N | DTXSID801337919 | AKOS015895797 | FT

Specifications & Purity

≥96%, Mixture of C16 & C18

Storage

Room temperature

Shipped In

Normal

Purity

≥96%

Names and Identifiers

• Pubchem Sid: 488198595
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488198595
• Canonical Smiles: CCCCCCCCCCCCCCCCCC(=O)OC1CC(NC(C1)(C)C)(C)C
• IUPAC Name: (2,2,6,6-tetramethylpiperidin-4-yl) octadecanoate
• InChIKey: JMUOXOJMXILBTE-UHFFFAOYSA-N
• INCHI: 1S/C27H53NO2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(29)30-24-22-26(2,3)28-27(4,5)23-24/h24,28H,6-23H2,1-5H3
• Isomeric SMILES: CCCCCCCCCCCCCCCCCC(=O)OC1CC(NC(C1)(C)C)(C)C
• PubChem CID: 14113416
• Molecular Weight: 423.72

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Fatty acid esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty acid esters
• Alternative Parents: Piperidines Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Fatty acid ester - Piperidine - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
• 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

• Melt Point(°C): ≥28℃
• Molecular Weight: 423.700 g/mol
• XLogP3: 9.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 18
• Exact Mass: 423.408 Da
• Monoisotopic Mass: 423.408 Da
• Topological Polar Surface Area: 38.300 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 428.000
• 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