17-Hydroxyheptadecanoic acid - ≥97% , CAS No.13099-34-8

CAS: 13099-34-8 Cat. No.: H332557 Fórmula: C₁₇H₃₄O₃ Peso molecular: 286.45

GRADE & PURITY ≥97%

Synonyms

MEGxp0_000326 | DTXSID60401791 | Q27148242 | Heptadecanoic acid, 17-hydroxy- | 17-HYDROXYHEPTADECANOICACID | AKOS003238396 | omega-hydroxyheptadecanoic acid | LMFA01050053 | omega-hydroxymargaric acid | 17-hydroxymargaric acid | BS-51053 | SCHEMBL506393 |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

MEGxp0_000326 | DTXSID60401791 | Q27148242 | Heptadecanoic acid, 17-hydroxy- | 17-HYDROXYHEPTADECANOICACID | AKOS003238396 | omega-hydroxyheptadecanoic acid | LMFA01050053 | omega-hydroxymargaric acid | 17-hydroxymargaric acid | BS-51053 | SCHEMBL506393 |

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488194813
• Sonrisas canónicas: C(CCCCCCCCO)CCCCCCCC(=O)O
• IUPAC Name: 17-hydroxyheptadecanoic acid
• InChIKey: JHRQMZPLCYCFPI-UHFFFAOYSA-N
• INCHI: 1S/C17H34O3/c18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17(19)20/h18H,1-16H2,(H,19,20)
• Isómeros SMILES: C(CCCCCCCCO)CCCCCCCC(=O)O
• Peso molecular: 286.45
• Reaxy-Rn: 1786333
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1786333&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Clase Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Long-chain fatty acids
• Alternative Parents: Hydroxy fatty acids Straight chain fatty acids Monocarboxylic acids and derivatives Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Long-chain fatty acid - Hydroxy fatty acid - Straight chain fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms.
• External Descriptors: Hydroxy fatty acids

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

• Solubilidad: Soluble in chloroform, warm ethanol, ethyl ether
• Peso molecular: 286.400 g/mol
• XLogP3: 5.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 16
• Exact Mass: 286.251 Da
• Monoisotopic Mass: 286.251 Da
• Topological Polar Surface Area: 57.500 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 204.000
• 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