Bis(1，2，2，6，6-pentamethyl-4-piperidyl) sebacate - ≥95%(GC), sum of monoester and diester , CAS No.41556-26-7

CAS: 41556-26-7 Cat. No.: B134649 Peso molecular: 508.79 Número EC: 255-437-1

GRADE & PURITY ≥95%(GC), sum of monoester and diester

Synonyms

2,2-bis(1,2,2,6,6-pentamethyl-4-piperidyl)decanedioate | Q17639670 | DHJ5QK3K4J | Decanedioic acid bis(1,2,2,6,6-pentamethylpiperidin-4-yl)ester | Nuclosina | bis(1,2,2,6,6-pentamethyl-4-piperidyl) decanedioate | NC00706 | Bis(1,2,2,6,6,-Pentamethyl-4-Pip

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

2, 2-bis(1, 2, 2, 6, 6-pentamethyl-4-piperidyl)decanedioate | Q17639670 | DHJ5QK3K4J | Decanedioic acid bis(1, 2, 2, 6, 6-pentamethylpiperidin-4-yl)ester | Nuclosina | bis(1, 2, 2, 6, 6-pentamethyl-4-piperidyl) decanedioate | NC00706 | Bis(1, 2, 2, 6, 6, -Pentamethyl-4-Pip

Especificaciones y pureza

≥95%(GC), sum of monoester and diester

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥95%(GC)

Nombres e identificadores

• Pubchem Sid: 504759379
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504759379
• Sonrisas canónicas: CC1(CC(CC(N1C)(C)C)OC(=O)CCCCCCCCC(=O)OC2CC(N(C(C2)(C)C)C)(C)C)C
• IUPAC Name: bis(1,2,2,6,6-pentamethylpiperidin-4-yl) decanedioate
• InChIKey: RSOILICUEWXSLA-UHFFFAOYSA-N
• INCHI: 1S/C30H56N2O4/c1-27(2)19-23(20-28(3,4)31(27)9)35-25(33)17-15-13-11-12-14-16-18-26(34)36-24-21-29(5,6)32(10)30(7,8)22-24/h23-24H,11-22H2,1-10H3
• Isómeros SMILES: CC1(CC(CC(N1C)(C)C)OC(=O)CCCCCCCCC(=O)OC2CC(N(C(C2)(C)C)C)(C)C)C
• Peso molecular: 508.79
• Reaxy-Rn: 1515460
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1515460&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty acid esters
• Alternative Parents: Piperidines Dicarboxylic acids and derivatives Trialkylamines Carboxylic acid esters Amino acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Fatty acid ester - Dicarboxylic acid or derivatives - Piperidine - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Aliphatic heteromonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive.
• Índice de refracción: 1.4810-1.4850
• Punto de inflamación (°C): 257 °C
• Punto de ebullición (°C): 222 °C/0.2 mmHg
• Peso molecular: 508.800 g/mol
• XLogP3: 6.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 13
• Exact Mass: 508.424 Da
• Monoisotopic Mass: 508.424 Da
• Topological Polar Surface Area: 59.100 Ų
• Heavy Atom Count: 36
• Formal Charge: 0
• Complexity: 645.000
• 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

Referencias

1. Xuefei Shao, Junnan He, Xuemei Zhao, Yubin Zheng, Nan Zheng.  (2021)  Preparation of zinc-coordinated-DPA functionalized polyesters for gene condensation.  JOURNAL OF APPLIED POLYMER SCIENCE,  138  (34): (50843).  [PMID:] [10.1002/app.50843]

2. Fei Lyu, Wei Sun, Sultan Ahmed Khoso, Chenyang Zhang, Runqing Liu, Li Wang, Jiande Gao.  (2019)  Adsorption mechanism of propyl gallate as a flotation collector on scheelite: A combined experimental and computational study.  MINERALS ENGINEERING,      [PMID:] [10.1016/j.mineng.2019.01.003]