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Dotriacontane - standard for GC,≥98.0%(GC), high purity , CAS No.544-85-4
Basic Description
Synonyms
Bicetyl | CH3-(CH2)30-CH3 | LMFA11000570 | n-Dotriacontane 100 microg/mL in n-Hexane | Dotriacontane, analytical standard | FT-0625591 | Dotriacontane, n- | M01641 | EINECS 208-881-5 | NSC 6361 | CH3-[CH2]30-CH3 | NSC6361 | NSC-6361 | D0998 | D89756 | WLN
Specifications & Purity
Standard for GC, ≥98%(GC)
Shipped In
Normal
Grade
Standard for GC
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Hydrocarbons
Class
Saturated hydrocarbons
Subclass
Alkanes
Intermediate Tree Nodes
Not available
Direct Parent
Alkanes
Alternative Parents
Not available
Molecular Framework
Aliphatic acyclic compounds
Substituents
Acyclic alkane - Alkane - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms.
External Descriptors
Hydrocarbons
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
IUPAC Name
dotriacontane
INCHI
InChI=1S/C32H66/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
InChIKey
QHMGJGNTMQDRQA-UHFFFAOYSA-N
Smiles
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
Isomeric SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
WGK Germany
3
RTECS
JT2360000
Molecular Weight
450.87
Beilstein
1783260
Reaxy-Rn
1783260
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1783260&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Refractive Index
1.455
Boil Point(°C)
467°C
Melt Point(°C)
69.7°C
Molecular Weight
450.900 g/mol
XLogP3
16.900
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
29
Exact Mass
450.516 Da
Monoisotopic Mass
450.516 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
32
Formal Charge
0
Complexity
264.000
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
Citations of This Product
1.
Xinxin He, Xiaoya Liu, Jun Tang, Haifeng Dong, Yasuhiro Sugawara, Yan Jun Li, Zongmin Ma, Jun Liu.
(2023)
Effect of Preparation Processes on Structural Thermal Stability and Collision Energy Dissipation of Common Antirelaxation Coatings on Quartz Substrates. LANGMUIR,
39
(36):
(12740–12753).
2.
Qing Du, Xin Shang, Yangyang Yuan, Xiong Su, Yanqiang Huang.
(2025)
Hydrocracking of Polyethylene to Gasoline-Range Hydrocarbons over a Ruthenium-Zeolite Bifunctional Catalyst System with Optimal Synergy of Metal and Acid Sites. Catalysts,
15
(4):
(335).
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2 Citations
F2217054