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Chlorinated paraffin - Chlorine content: 42%, high purity , CAS No.63449-39-8
Basic Description
Synonyms
63449-39-8 | Cereclor | Chlorcosane | Arubren | Chlorowax | Flexchlor | Unichlor | Paroil chlorez | Arubren CP | Cerechlor 54 | Chloroflo 35 | Chloroflo 40 | Chloroflo 42 | Cereclor 30 | Cereclor 42 | Cereclor 48 | Cereclor 52 | Cereclor 54 | Cereclor 70 | Unichlor 50 | Cereclor 50LV | Cereclor 5
Specifications & Purity
Chlorine content: 42%
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organohalogen compounds
Class
Organochlorides
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Organochlorides
Alternative Parents
Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as organochlorides. These are compounds containing a chemical bond between a carbon atom and a chlorine atom.
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.
Associated Targets(Human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
4,8,11,14,17,21-hexachlorotetracosane
INCHI
InChI=1S/C24H44Cl6/c1-3-7-19(25)9-5-11-21(27)13-15-23(29)17-18-24(30)16-14-22(28)12-6-10-20(26)8-4-2/h19-24H,3-18H2,1-2H3
InChIKey
QKUNKVYPGIOQNP-UHFFFAOYSA-N
Smiles
CCCC(CCCC(CCC(CCC(CCC(CCCC(CCC)Cl)Cl)Cl)Cl)Cl)Cl
Isomeric SMILES
CCCC(CCCC(CCC(CCC(CCC(CCCC(CCC)Cl)Cl)Cl)Cl)Cl)Cl
Alternate CAS
85422-92-0
PubChem CID
6537497
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
545.300 g/mol
XLogP3
11.000
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
21
Exact Mass
544.154 Da
Monoisotopic Mass
542.157 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
30
Formal Charge
0
Complexity
334.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
6
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Citations of This Product
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