3-Buten-1-amine

Base Information

• Chemical Name: 3-Buten-1-amine
• CAS No.: 2524-49-4
• Molecular Formula: C4H9 N
• Molecular Weight: 71.1222
• Hs Code.: 2921199090
• European Community (EC) Number: 680-738-3
• DSSTox Substance ID: DTXSID50332126
• Nikkaji Number: J674.246G
• Wikidata: Q27114138
• Metabolomics Workbench ID: 69852
• Mol file: 2524-49-4.mol

Synonyms:3-Buten-1-amine;2524-49-4;But-3-en-1-amine;homoallylamine;3-butene-1-amine;3-BUTENYLAMINE;4-AMINO-1-BUTENE;C12244;ACMC-1B0ZE;AC1L9F3E;n-but-3-enylamine;But-3-ene-1-amine;BUT-3-ENYLAMINE;CHEBI:31108;DTXSID50332126;ASVKKRLMJCWVQF-UHFFFAOYSA-N;MFCD03425859;AKOS000276646;AB14698;AT25938;SB11689;783295-28-3;CS-0227046;EN300-96305;A817731;A833963;J-015887;Q27114138

Chemical Property of 3-Buten-1-amine

Chemical Property:

• Vapor Pressure: 78.5mmHg at 25°C
• Refractive Index: 1.4240
• Boiling Point: 82.5°Cat760mmHg
• PKA: 9.96±0.10(Predicted)
• Flash Point: °C
• PSA: 26.02000
• Density: 0.761g/cm³
• LogP: 1.22150
• Sensitive.: Air Sensitive
• Water Solubility.: Miscible with water.
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 71.073499291
• Heavy Atom Count: 5
• Complexity: 24.8

Purity/Quality:

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

3-Buten-1-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R11:Highly flammable.; R34:Causes burns.
• Hazard Codes: R11:Highly flammable.; R34:Causes burns.
• Statements: 11-34
• Safety Statements: 16-26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCCN
• Uses: 3-Buten-1-amine is an aliphatic terminal amine used for organic synthesis and in proteomics research. Its hydrochloride salt is used to improve the detection of neurodegenerative alzheimer?s disease in ELISA titrations by reducing the background due to non-specific associations of molecules and proteins.

Technology Process of 3-Buten-1-amine

There total 2 articles about 3-Buten-1-amine 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:

N-(3-butenyl)phthalimide (52898-32-5) → 2,3-dihydrophthalazine-1,4-dione (1445-69-8) + 3-butene-1-amine (2524-49-4)

Guidance literature:

With hydrazine hydrate; In ethanol; at 80 ℃; for 4h;

DOI:10.1002/chem.201805318

Reference yield:

formaldehyd (50-00-0,30525-89-4,61233-19-0) + sulfuric acid (7664-93-9) + 1-Allyl-1-phenyl-3-butenylamine (19243-52-8) → 3-butene-1-amine (2524-49-4) + 1-phenylbut-3-en-1-one (6249-80-5)

Guidance literature:

DOI:10.1021/ja01160a025

Reference yield: 99.0%

3-butene-1-amine (2524-49-4) + 4-methoxy-benzaldehyde (123-11-5) → N-(4-methoxybenzyl)-3-buten-1-ylamine (664342-18-1)

Guidance literature:

3-butene-1-amine; 4-methoxy-benzaldehyde; With magnesium sulfate; triethylamine; In dichloromethane; at 20 ℃;

With methanol; sodium tetrahydroborate; at 0 ℃; for 2h;

upstream raw materials:

formaldehyd

sulfuric acid

1-Allyl-1-phenyl-3-butenylamine

N-(3-butenyl)phthalimide

Downstream raw materials:

N-but-3-enyl-N'-phenyl-urea

4-isothiocyanato-1-butene

(1-buten-4-ylamino)phenylchloroborane

1,3,5-Tri-but-3-enyl-2,4,6-triphenyl-[1,3,5,2,4,6]triazatriborinane

Refernces