Basic Description

Synonyms	4-Methylpent-1-ene
Specifications & Purity	≥97%(GC)
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Hydrocarbons
  - Class Unsaturated hydrocarbons
    - Subclass Unsaturated aliphatic hydrocarbons

Kingdom	Organic compounds
Superclass	Hydrocarbons
Class	Unsaturated hydrocarbons
Subclass	Unsaturated aliphatic hydrocarbons
Intermediate Tree Nodes	Not available
Direct Parent	Unsaturated aliphatic hydrocarbons
Alternative Parents	Alkenes
Molecular Framework	Aliphatic acyclic compounds
Substituents	Unsaturated aliphatic hydrocarbon - Olefin - Alkene - Acyclic olefin - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as unsaturated aliphatic hydrocarbons. These are aliphatic Hydrocarbons that contains one or more unsaturated carbon atoms. These compounds contain one or more double or triple bonds.
External Descriptors	Not available
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. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504752385
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504752385
IUPAC Name	4-methylpent-1-ene
INCHI	InChI=1S/C6H12/c1-4-5-6(2)3/h4,6H,1,5H2,2-3H3
InChIKey	WSSSPWUEQFSQQG-UHFFFAOYSA-N
Smiles	CC(C)CC=C
Isomeric SMILES	CC(C)CC=C
WGK Germany	3
UN Number	1993
Packing Group	I
Molecular Weight	84.16
Beilstein	1731100
Reaxy-Rn	1731096
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731096&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

12 results found

Lot Number	Certificate Type	Date	Item
L2031475	Certificate of Analysis	Nov 14, 2024	M158219
E2416318	Certificate of Analysis	May 10, 2024	M158219
E2416330	Certificate of Analysis	May 10, 2024	M158219
E2416332	Certificate of Analysis	May 10, 2024	M158219
L2206666	Certificate of Analysis	Nov 21, 2022	M158219
L2206692	Certificate of Analysis	Nov 21, 2022	M158219
L2206724	Certificate of Analysis	Nov 21, 2022	M158219
G2219610	Certificate of Analysis	Jun 06, 2022	M158219
G2219613	Certificate of Analysis	Jun 06, 2022	M158219
D2220115	Certificate of Analysis	Mar 07, 2022	M158219
D2220113	Certificate of Analysis	Mar 07, 2022	M158219
D2220114	Certificate of Analysis	Mar 07, 2022	M158219

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Chemical and Physical Properties

Refractive Index	1.38
Flash Point(°F)	-25°F
Flash Point(°C)	-32 °C
Boil Point(°C)	53 °C
Melt Point(°C)	-153 °C
Molecular Weight	84.160 g/mol
XLogP3	2.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Exact Mass	84.0939 Da
Monoisotopic Mass	84.0939 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	35.300
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

How to Cite Aladdin Scientific Products?

1. Yuhao Zhang, Mengmeng Liu, Liang Zhao, Suxin Liu, Jinsen Gao, Chunming Xu, Mingzhi Ma, Qingfei Meng. (2021) Modeling, simulation, and optimization for producing ultra-low sulfur and high-octane number gasoline by separation and conversion of fluid catalytic cracking naphtha. FUEL, 299 (120740).

Solution Calculators

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SKU	Size	Availability	Price
M158219-5ml	5ml	3	$29.90
M158219-25ml	25ml	5	$89.90
M158219-100ml	100ml	2	$311.90

4-Methyl-1-pentene - >97.0%(GC), high purity , CAS No.691-37-2