Octadecanaldehyde - ≥95%(GC) , CAS No.638-66-4

CAS: 638-66-4 Cat. No.: O134521 Peso molecular: 268.49 Beilstein Registry Number: 1(1)373 Número EC: 211-346-9

GRADE & PURITY ≥95%(GC)

Synonyms

CHEBI:17034 | O0368 | OCTADECANAL | H11152 | HY-W004307 | SCHEMBL3471 | DTXSID60213250 | MFCD03790007 | Stearaldehyde | PH4GZ7JT4C | Octadecanaldehyde | n-Octadecanal | NSC 68100 | EINECS 211-346-9 | LMFA06000098 | 1-octadecanal | 1--Octadecanal | Stearyl

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

CHEBI:17034 | O0368 | OCTADECANAL | H11152 | HY-W004307 | SCHEMBL3471 | DTXSID60213250 | MFCD03790007 | Stearaldehyde | PH4GZ7JT4C | Octadecanaldehyde | n-Octadecanal | NSC 68100 | EINECS 211-346-9 | LMFA06000098 | 1-octadecanal | 1--Octadecanal | Stearyl

Especificaciones y pureza

≥95%(GC)

Condiciones de almacenamiento de almacenamiento

Store at -20°C, Argon charged

Enviado en

Ice chest + Ice pads

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

Pureza

≥95%(GC)

Nombres e identificadores

• Pubchem Sid: 504752364
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752364
• Sonrisas canónicas: CCCCCCCCCCCCCCCCCC=O
• IUPAC Name: octadecanal
• InChIKey: FWWQKRXKHIRPJY-UHFFFAOYSA-N
• INCHI: 1S/C18H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h18H,2-17H2,1H3
• Isómeros SMILES: CCCCCCCCCCCCCCCCCC=O
• RTECS: RG0181500
• Peso molecular: 268.49
• Beilstein: 1(1)373
• Reaxy-Rn: 1777275
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1777275&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty aldehydes
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty aldehydes
• Alternative Parents: Alpha-hydrogen aldehydes Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty aldehyde - Alpha-hydrogen aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as fatty aldehydes. These are long chain aldehydes with a chain of at least 12 carbon atoms.
• External Descriptors: a small molecule

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. Air sensitive.Heat sensitive
• Punto de ebullición (°C): 215°C/20mmHg
• Punto de fusión (°C): 43-47°C
• Peso molecular: 268.500 g/mol
• XLogP3: 8.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 16
• Exact Mass: 268.277 Da
• Monoisotopic Mass: 268.277 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 165.000
• 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. Yushi Liu, Wan-Qiu Liu, Shuhui Huang, Huiling Xu, Haofan Lu, Changzhu Wu, Jian Li.  (2022)  Cell-free metabolic engineering enables selective biotransformation of fatty acids to value-added chemicals.  Metabolic Engineering Communications,      [PMID:36578475] [10.1016/j.mec.2022.e00217]

2. Junmei Liang, Zhenyi Zhang, Kejing Wu, Yanchun Shi, Weihua Pu, Mingde Yang, Yulong Wu.  (2019)  Improved conversion of stearic acid to diesel-like hydrocarbons by carbon nanotubes-supported CuCo catalysts.  FUEL PROCESSING TECHNOLOGY,      [PMID:] [10.1016/j.fuproc.2019.02.017]

3. Rong Wang, Jin Li, Jia-Jia Chen, Yu Guo, Yue Hu, Xiao-Qi Yu, Ji Zhang.  (2024)  Cationic lipids via multi-component Passerini reaction for non-viral gene delivery.  NEW JOURNAL OF CHEMISTRY,  48  (9): (4175-4183).  [PMID:] [10.1039/D3NJ05949A]

4. Xuwen Zhang, Xuexue Dong, Youting Wang, Juanjuan Bian, Sajid Ali, Dongren Cai, Kang Sun, Xiaoping Rao, Jianchun Jiang, Guowu Zhan.  (2025)  Metal–Organic Frameworks-Derived Cobalt Catalyst Supported on Biochar for Efficient Deoxygenation of Stearic Acid.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.4c03679]

5. Honglin Li, Ya Chen, Yue Qiu.  (2025)  Oxytocin lipidation expanding therapeutics for long-term reversal of autistic behaviors in rats.  INTERNATIONAL JOURNAL OF PHARMACEUTICS,      [PMID:39890086] [10.1016/j.ijpharm.2025.125299]

6. Zhengting Xiao, Dongcai Shen, Kai Guo, Guangci Li, Wentai Wang, Xuebing Li, Song Chen, Chunhu Li.  (2025)  Selective hydrogenolysis of methyl stearate into stearyl alcohol by synergistic catalysis of Cu+ species with the surface oxygen vacancies of ZnAl2O4 spinel.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.161362]

7. Zhiye Yan, Weiwei Tang, Bin Li.  (2025)  Expanding Metabolome Coverage in LC–MS/MS Analysis through Hydralazine-Based Multifunctional Derivatization.  ANALYTICAL CHEMISTRY,      [PMID:41277254] [10.1021/acs.analchem.5c02101]

8. Xuexue Dong, Benhuan Xu, Jian Tian, Bo Jiang, Yu Deng, Bin Chen, Yixin Li, Gen Li, Guowu Zhan.  (2026)  Dual-site Re/In2O3 enables selective hydrodeoxygenation of fatty acids via suppressed decarbonylation.  AICHE JOURNAL,      [PMID:] [10.1002/aic.70304]