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4,4-Dimethyl-1-pentene - >99.0%(GC), high purity , CAS No.762-62-9

COA

Grade & Purity:

≥99%(GC)

Cas Number: 762-62-9
Molecular Weight: 98.19
Beilstein Registry Number: 1731850
MDL number: MFCD00026337
PubChem CID: 12984

In stock

Item Number

D155429

Grouped product items
SKU	Size	Availability	Price	Qty
D155429-1ml	1ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$199.90
D155429-5ml	5ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$897.90

View related series

Non heterocyclic block (8163) olefin (158)

Basic Description

Synonyms	EINECS 212-101-9 \| Neoheptaene \| AKOS009159100 \| 4,4-dimethyl-pent-1-ene \| 4,4-Dimethylpent-1-ene \| GEO-03802 \| InChI=1/C7H14/c1-5-6-7(2,3)4/h5H,1,6H2,2-4H \| (CH3)3CCH2CH=CH2 \| 1-Pentene, 4,4-dimethyl- \| DTXSID6073235 \| EN300-740152 \| NSC73923 \| NSC-73923
Specifications & Purity	≥99%(GC)
Shipped In	Normal

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

IUPAC Name	4,4-dimethylpent-1-ene
INCHI	InChI=1S/C7H14/c1-5-6-7(2,3)4/h5H,1,6H2,2-4H3
InChIKey	KLCNJIQZXOQYTE-UHFFFAOYSA-N
Smiles	CC(C)(C)CC=C
Isomeric SMILES	CC(C)(C)CC=C
WGK Germany	3
Molecular Weight	98.19
Beilstein	1731850
Reaxy-Rn	1731848
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731848&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Refractive Index	1.39
Flash Point(°F)	10.4 °F
Flash Point(°C)	-12°C(lit.)
Boil Point(°C)	72°C
Molecular Weight	98.190 g/mol
XLogP3	3.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	2
Exact Mass	98.1096 Da
Monoisotopic Mass	98.1096 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	54.900
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

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