CAS 123-48-8

2,2,4,6,6-Pentamethyl-3-heptene

Description:

2,2,4,6,6-Pentamethyl-3-heptene is an organic compound characterized by its structure as a branched alkene. It features a seven-carbon chain with a double bond located at the third carbon, along with five methyl groups attached to the second, fourth, and sixth carbons. This unique arrangement contributes to its high degree of branching, which influences its physical properties. The compound is typically a colorless liquid at room temperature and exhibits a relatively low boiling point compared to straight-chain alkenes of similar molecular weight. Its branched structure results in lower density and viscosity. 2,2,4,6,6-Pentamethyl-3-heptene is known for its stability and resistance to oxidation, making it useful in various chemical applications, including as a potential intermediate in organic synthesis. Additionally, due to its unsaturation, it can participate in various chemical reactions, such as polymerization and addition reactions. Safety data indicates that, like many organic solvents, it should be handled with care to avoid inhalation or skin contact.

Formula: C₁₂H₂₄

InChI: InChI=1S/C12H24/c1-10(8-11(2,3)4)9-12(5,6)7/h8H,9H2,1-7H3

InChI key: InChIKey=NBUMCEJRJRRLCA-UHFFFAOYSA-N

SMILES: C(C(C)(C)C)C(=CC(C)(C)C)C

Synonyms:

• 2,2,4,6,6-Pentamethyl-3-heptene
• 3-Heptene, 2,2,4,6,6-pentamethyl-

3-Heptene, 2,2,4,6,6-pentamethyl-

CAS: 123-48-8

Formula: C₁₂H₂₄

Molecular weight: 168.319

Ref: IN-DA000JX4

2,2,4,6,6-Pentamethyl-3-Heptene

CAS: 123-48-8

Formula: C₁₂H₂₄

Molecular weight: 168.32

Ref: 4Z-H-041001

ASTM Method D5441 Quantitative Standard without 3,5-Dimethyl-1-hexene in Dodecane (C12)

Controlled Product

CAS: 107-39-1, 107-40-4, 107-83-5, 109-66-0, 109-67-1, 123-48-8, 141-70-8, 142-29-0, 1634-04-4, 39761-57-4, 513-35-9, 563-45-1, 563-46-2, 563-78-0, 565-77-5, 627-20-3, 637-92-3, 646-04-8, 67-56-1, 67-63-0, 67-64-1, 6795-87-5, 691-38-3, 75-65-0, 78-78-4, 78-93-3, 96-14-0, 994-05-8

Formula: C₅H₁₀

Color and Shape: Mixture

Molecular weight: 70.13

Ref: 04-GA09000646DO

ASTM Method D5441 Methyl tert-butyl ether Contaminant Standard Low Concentration

Controlled Product

CAS: 107-39-1, 109-66-0, 123-48-8, 141-70-8, 513-35-9, 627-20-3, 637-92-3, 646-04-8, 67-56-1, 75-65-0, 78-78-4, 994-05-8

Formula: C₁₂H₂₄

Color and Shape: Mixture

Molecular weight: 168.32

Ref: 04-GS0900081MB

2,2,4,6,6-Pentamethyl-3-heptene

CAS: 123-48-8

2,2,4,6,6-Pentamethyl-3-heptene is a polymerized alkene that is used as a soil bactericide. It has been shown to have radical mechanism of action and exhibits potent antibacterial activity against Gram-positive bacteria. 2,2,4,6,6-Pentamethyl-3-heptene contains two isomers: 2,2-dimethylheptane and 2,4,6-trimethylheptane. These isomers are differentiated by their physicochemical properties such as boiling point and molecular weight. The chemical substances in 2,2,4,6,6-pentamethyl-3-heptene can be analyzed using gas chromatography with mass spectrometry (GC/MS).

Formula: C₁₂H₂₄

Purity: 85 To 90 Area-%

Color and Shape: Clear Liquid

Molecular weight: 168.32 g/mol

Ref: 3D-FP171991

2,2,4,6,6-Pentamethyl-3-heptene (>85%)

Controlled Product

CAS: 123-48-8

Formula: C₁₂H₂₄

Color and Shape: Colourless

Molecular weight: 168.32

Ref: TR-P123480

ASTM Method D5441 Methyl tert-butyl ether Contaminant Standard Low Concentration

Controlled Product

CAS: 107-39-1, 109-66-0, 123-48-8, 141-70-8, 513-35-9, 627-20-3, 637-92-3, 646-04-8, 67-56-1, 75-65-0, 78-78-4, 994-05-8

Color and Shape: Mixture

Ref: 04-GA0900086MB