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Dodecyl arachidate - >99%, high purity , CAS No.42232-82-6
Basic Description
Synonyms
ARACHIDIC ACID LAURYL ESTER | Dodecyl Icosanoate | WE(12:0/20:0) | Dodecyl arachidate | dodecyl eicosanoate | LMFA07010041 | DTXSID50410539 | AKOS024386245 | arachidoyl dodecanoate | Eicosanoic acid dodecyl ester | Dodecyl arachidate, >=99% | FT-0716295 |
Specifications & Purity
≥99%
Storage Temp
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acid esters
Intermediate Tree Nodes
Wax esters
Direct Parent
Wax monoesters
Alternative Parents
Fatty alcohol esters Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Wax monoester skeleton - Fatty alcohol ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as wax monoesters. These are waxes bearing an ester group at exactly one position.
External Descriptors
Wax monoesters
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.
Names and Identifiers
Pubchem Sid
504763262
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504763262
IUPAC Name
dodecyl icosanoate
INCHI
InChI=1S/C32H64O2/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-26-28-30-32(33)34-31-29-27-25-23-14-12-10-8-6-4-2/h3-31H2,1-2H3
InChIKey
GFFYHZLIDINABP-UHFFFAOYSA-N
Smiles
CCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCC
Isomeric SMILES
CCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCC
Molecular Weight
480.85
Reaxy-Rn
1888711
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1888711&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
480.800 g/mol
XLogP3
15.200
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
30
Exact Mass
480.491 Da
Monoisotopic Mass
480.491 Da
Topological Polar Surface Area
26.300 Ų
Heavy Atom Count
34
Formal Charge
0
Complexity
379.000
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
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C2222583