Palmitic acid-1-(¹³C) - ≥99 atom% 13C , CAS No.57677-53-9

CAS: 57677-53-9 Cat. No.: P346808 Summenformel: (¹³C)C₁₅H₃₂O₂ Molekulargewicht: 257.42 EG-Nummer: 624-077-0

QUALITÄT & REINHEIT ≥99 atom% 13C

Synonyms

2QQO35IYD7 | D78975 | HEXADECANOICACID-1-¹³C | Palmitic acid-1-(¹³-C) | DTXSID40432301 | HY-N0830S3 | starbld0016623 | Hexadecanoic acid-1-¹³C | Hexadecanoic-1-¹³c acid | SCHEMBL1332805 | Palmitic acid-1-¹³C, S & P tested, 99 atom % ¹³C | Palmitic acid-1-

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Übersicht

Application：
Lipidomics, Metabolism, Metabolomics

Spezifikationen

Synonyme

2QQO35IYD7 | D78975 | HEXADECANOICACID-1-¹³C | Palmitic acid-1-(¹³-C) | DTXSID40432301 | HY-N0830S3 | starbld0016623 | Hexadecanoic acid-1-¹³C | Hexadecanoic-1-¹³c acid | SCHEMBL1332805 | Palmitic acid-1-¹³C, S & P tested, 99 atom % ¹³C | Palmitic acid-1-

Spezifikationen & Reinheit

≥99 atom% 13C

Storage

Protected from light,Store at -20°C,Argon charged

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥99 atom% 13C

Namen und Kennungen

Pubchem Sid

504765036

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504765036

Kanonisches Lächeln

CCCCCCCCCCCCCCCC(=O)O

IUPAC Name

(113C)hexadecanoic acid

InChIKey

IPCSVZSSVZVIGE-LOYIAQTISA-N

INCHI

1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/i16+1

Isomere SMILES

CCCCCCCCCCCCCCC[13C](=O)O

Alternative CAS-Nummer

57-10-3（Unlabeled）

Molekulargewicht

257.42

Reaxy-Rn

607489

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=607489&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Klasse: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Long-chain fatty acids
• Alternative Parents: Straight chain fatty acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Long-chain fatty acid - Straight chain fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Beschreibung: 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: 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light sensitive；Moisture sensitive
• Siedepunkt (°C): 271.5° C (lit.) at 100 mmHg
• Schmelzpunkt (°C): 61-64°C
• Molekulargewicht: 257.420 g/mol
• XLogP3: 6.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 14
• Exact Mass: 257.244 Da
• Monoisotopic Mass: 257.244 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 178.000
• Isotope Atom Count: 1
• 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

Häufig gestellte Fragen

What is the isotopic enrichment of this product?

This product is isotopically enriched to ≥99 atom% carbon-13. Isotopic enrichment is a separate specification from chemical purity — a labelled compound has both. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 57677-53-9, the molecular formula is (13C)C15H32O2, and the molecular weight is 257.42 g/mol. InChIKey IPCSVZSSVZVIGE-LOYIAQTISA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.