Palmitic Anhydride - ≥96% , CAS No.623-65-4

CAS: 623-65-4 Cat. No.: P160066 Fórmula: C₃₂H₆₂O₃ Peso molecular: 494.85 Beilstein Registry Number: 1807510 Número CE: 210-805-0 PubChem CID: 69339

GRADE & PURITY ≥96%

Synonyms

HY-W093183 | Palmitic anhydride | n-hexadecanoic anhydride | SCHEMBL149967 | AKOS016013112 | FT-0632621 | 2-(4-METHOXY-PHENYLAMINO)-4-NITRO-BENZOICACID | hexadecanoyl hexadecanoate | NSC 285112 | P0008 | hexadecanoic acid anhydride | Hexadecanoic anhydrid

Storage

Room temperature,Argon charged

Shipped In

Normal

Visão geral

It reacted with 20-methyl spirolide G to form a derivative with a retention time and spectrum identical with the metabolite, 17-O-palmitoyl-20-methyl spirolide G.
It was used in the synthesis of water-soluble N-palmitoyl chitosan (PLCS) by coupling with swollen chitosan in dimethyl sulfoxide (DMSO). It was also used in the synthesis of N-acylphosphatidylserine.

Specifications

Sinónimos

HY-W093183 | Palmitic anhydride | n-hexadecanoic anhydride | SCHEMBL149967 | AKOS016013112 | FT-0632621 | 2-(4-METHOXY-PHENYLAMINO)-4-NITRO-BENZOICACID | hexadecanoyl hexadecanoate | NSC 285112 | P0008 | hexadecanoic acid anhydride | Hexadecanoic anhydrid

Especificações e pureza

≥96%

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥96%

Nomes e identificadores

• Pubchem Sid: 488184295
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184295
• Sorrisos canónicos: CCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCC
• IUPAC Name: hexadecanoyl hexadecanoate
• InChIKey: QWZBEFCPZJWDKC-UHFFFAOYSA-N
• INCHI: 1S/C32H62O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31(33)35-32(34)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-30H2,1-2H3
• SMILES isoméricas: CCCCCCCCCCCCCCCC(=O)OC(=O)CCCCCCCCCCCCCCC
• WGK Alemanha: 3
• PubChem CID: 69339
• Peso molecular: 494.85
• Beilstein: 1807510
• Reaxy-Rn: 1807507

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Dicarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Dicarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Dicarboxylic acids and derivatives
• Alternative Parents: Carboxylic acid anhydrides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dicarboxylic acid or derivatives - Carboxylic acid anhydride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
• 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

Propriedades químicas e físicas

• Sensibilidade: Moisture Sensitive
• Ponto de fusão (°C): 64 °C
• Peso molecular: 494.800 g/mol
• XLogP3: 14.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 30
• Exact Mass: 494.47 Da
• Monoisotopic Mass: 494.47 Da
• Topological Polar Surface Area: 43.400 Ų
• Heavy Atom Count: 35
• Formal Charge: 0
• Complexity: 406.000
• 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

Referências

1. Ran Zhang, Xue-Qing Song, Rui-Ping Liu, Zhong-Ying Ma, Jing-Yuan Xu.  (2019)  Fuplatin: An Efficient and Low-Toxic Dual-Prodrug.  JOURNAL OF MEDICINAL CHEMISTRY,      [PMID:31002510] [10.1021/acs.jmedchem.9b00128]