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1-Iodopentane - 98%,contains copper as stabilizer, high purity , CAS No.628-17-1
Basic Description
Synonyms
1-Jodpentan [Czech] | EINECS 211-030-0 | J-802039 | n-pentyliodide | n-Pentyl iodide | NSC 7901 | Amyljodid | UNII-GQ3RVU6PSC | NSC7901 | NSC-7901 | Pentane, 1-iodo- | 1-Iodopentane, 98% | AS-17294 | J-802261 | InChI=1/C5H11I/c1-2-3-4-5-6/h2-5H2,1H3 | n-A
Specifications & Purity
≥98%(GC), stabilized with copper
Storage Temp
Protected from light,Argon charged
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organohalogen compounds
Class
Organoiodides
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Organoiodides
Alternative Parents
Hydrocarbon derivatives Alkyl iodides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Hydrocarbon derivative - Organoiodide - Alkyl iodide - Alkyl halide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as organoiodides. These are compounds containing a chemical bond between a carbon atom and an iodine 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
488181627
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488181627
IUPAC Name
1-iodopentane
INCHI
InChI=1S/C5H11I/c1-2-3-4-5-6/h2-5H2,1H3
InChIKey
BLXSFCHWMBESKV-UHFFFAOYSA-N
Smiles
CCCCCI
Isomeric SMILES
CCCCCI
WGK Germany
3
RTECS
SA2975600
UN Number
1993
Molecular Weight
198.05
Beilstein
1730982
Reaxy-Rn
1730982
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730982&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Sensitive to air; sensitive to light
Refractive Index
1.4955
Flash Point(°F)
109.4 °F
Flash Point(°C)
45℃
Boil Point(°C)
155°C
Melt Point(°C)
-85.6°C
Molecular Weight
198.050 g/mol
XLogP3
3.600
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
3
Exact Mass
197.991 Da
Monoisotopic Mass
197.991 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
6
Formal Charge
0
Complexity
19.900
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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