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1,5-Dichloropentane - 99%, high purity , CAS No.628-76-2
Basic Description
Synonyms
NSC 6210 | A834062 | UNII-6N4A5V83WE | Pentamethylene chloride | 4-01-00-00310 (Beilstein Handbook Reference) | D0390 | FT-0606956 | Q27265185 | 6N4A5V83WE | AKOS000120031 | EN300-19879 | WLN: G5G | AI3-16489 | Amylene chloride | J-504017 | 1,5-Dichlorope
Specifications & Purity
≥99%
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.
Names and Identifiers
Pubchem Sid
488181636
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488181636
IUPAC Name
1,5-dichloropentane
INCHI
InChI=1S/C5H10Cl2/c6-4-2-1-3-5-7/h1-5H2
InChIKey
LBKDGROORAKTLC-UHFFFAOYSA-N
Smiles
C(CCCl)CCCl
Isomeric SMILES
C(CCCl)CCCl
WGK Germany
2
RTECS
SA0350000
Molecular Weight
141.04
Beilstein
1732340
Reaxy-Rn
1732340
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732340&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Miscible with ethanol, ether and chloroform. Immiscible with water.
Refractive Index
1.45
Flash Point(°C)
26°C
Boil Point(°C)
182°C
Melt Point(°C)
-72°C
Molecular Weight
141.040 g/mol
XLogP3
2.500
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
4
Exact Mass
140.016 Da
Monoisotopic Mass
140.016 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
7
Formal Charge
0
Complexity
25.300
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
Citations of This Product
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