2-Methyl-3-buten-1-ol

Base Information

• Chemical Name: 2-Methyl-3-buten-1-ol
• CAS No.: 4516-90-9
• Deprecated CAS: 59014-12-9
• Molecular Formula: C5H10O
• Molecular Weight: 86.1338
• European Community (EC) Number: 625-583-4
• DSSTox Substance ID: DTXSID00863410
• Nikkaji Number: J421.727F
• Wikidata: Q82854448
• Metabolomics Workbench ID: 3193
• Mol file: 4516-90-9.mol

Synonyms:2-Methyl-3-buten-1-ol;2-methylbut-3-en-1-ol;4516-90-9;3-Buten-1-ol, 2-methyl-;2-methyl-but-3-en-1-ol;2-methyl-3-butene-1-ol;1-hydroxy-2-methyl-3-butene;NVGOATMUHKIQQG-UHFFFAOYSA-;DTXSID00863410;CHEBI:165505;2-Methyl-3-buten-1-ol, 98%;LMFA05000103;AKOS015912823;HY-147113;FT-0635340;EN300-114046;A936282

Chemical Property of 2-Methyl-3-buten-1-ol

Chemical Property:

• Vapor Pressure: 7.3mmHg at 25°C
• Melting Point: 33.52°C
• Refractive Index: n20/D 1.427(lit.)
• Boiling Point: 120-121 °C/756 mmHg (lit.)
• Flash Point: 92?°F
• Density: 0.835 g/mL at 25 °C (lit.)
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 86.073164938
• Heavy Atom Count: 6
• Complexity: 41.2

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Methyl-3-buten-1-ol 98% ^*data from reagent suppliers

Safty Information:

• Statements: 10
• Safety Statements: 16-29-33

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(CO)C=C

Technology Process of 2-Methyl-3-buten-1-ol

There total 10 articles about 2-Methyl-3-buten-1-ol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 84.0%

2-methylbut-3-enoic acid (53774-20-2) → 2-methyl-3-buten-1-ol (4516-90-9)

Guidance literature:

With lithium aluminium tetrahydride;

DOI:10.1016/S0040-4020(01)86350-X

Reference yield: 81.0%

epoxybutene (930-22-3,62249-81-4) + methyllithium (917-54-4) → 1-Penten-3-ol (616-25-1) + 2-methyl-3-buten-1-ol (4516-90-9)

Guidance literature:

With tris(bis(trimethylsilyl)amido)samarium(III); for 23h; Product distribution; Ambient temperature; further organoyttrium- and organolanthanoid-reagents;

Reference yield: 66.0%

(E)-1-Bromo-2-butene (4784-77-4,39616-19-8,29576-14-5) → 2-methyl-3-buten-1-ol (4516-90-9)

Guidance literature:

With ammonium chloride; magnesium; paraformaldehyde; In (2S)-N-methyl-1-phenylpropan-2-amine hydrate;

upstream raw materials:

2-methylbut-3-enoic acid

epoxybutene

methyllithium

lithium dimethylcuprate * lithium iodide

Downstream raw materials:

(±)-2-methylbut-3-en-1-yl 4-methylbenzenesulfonate

C₂₅H₃₀OSi₂

(E)-2-methyl-4-(1-tosyl-1H-indol-4-yl)but-3-en-2-ol

[(RS)-2-methylbut-3-enyloxymethyl]benzene