3-Butenylamine hydrochloride

Base Information

• Chemical Name: 3-Butenylamine hydrochloride
• CAS No.: 17875-18-2
• Molecular Formula: C4H9 N . Cl H
• Molecular Weight: 107.583
• Hs Code.: 2921199090
• European Community (EC) Number: 627-654-5
• DSSTox Substance ID: DTXSID90494277
• Mol file: 17875-18-2.mol

Synonyms:17875-18-2;3-Butenylamine hydrochloride;But-3-en-1-amine hydrochloride;1-Amino-3-butene hydrochloride;3-Buten-1-amine hydrochloride;but-3-en-1-amine;hydrochloride;3-Buten-1-amine, hydrochloride (9CI);BUT-3-EN-1-AMINE HCL;MFCD05663670;3-Buten-1-amine, hydrochloride;but-3-en-1-amine,hydrochloride;1-AMINO-3-BUTENEHYDROCHLORIDE;1-Amino-3-butene HCl;SCHEMBL519595;But-3-en-1-aminehydrochloride;DTXSID90494277;but-3-en-1-ylamine hydrochloride;MKEXLMVYRUNCQJ-UHFFFAOYSA-N;3-Butenylamine hydrochloride, 97%;BCP25735;AKOS015912013;DS-8953;HY-W019321;SB11690;SY036713;CS-0028781;FT-0693105;But-3-en-1-amine--hydrogen chloride (1/1);EN300-191610;A905360;J-011399;1-Amino-3-butene Hydrochloride

Chemical Property of 3-Butenylamine hydrochloride

Chemical Property:

• Vapor Pressure: 78.5mmHg at 25°C
• Melting Point: 176-180 °C(lit.)
• Boiling Point: 82.5°C at 760 mmHg
• PSA: 26.02000
• LogP: 2.02350
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 107.0501770
• Heavy Atom Count: 6
• Complexity: 24.8

Purity/Quality:

98%, ^*data from raw suppliers

3-Butenylamine hydrochloride ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T
• Statements: 25-37/38-41-42/43
• Safety Statements: 22-26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCCN.Cl
• Uses: 3-Butenylamine hydrochloride can be used to synthesize 2-(3-butenylamino)-3-chloronaphthalene-1,4-dione via reaction with 2,3-dichloro-1,4-naphthoquinone in the presence of sodium bicarbonate.

Technology Process of 3-Butenylamine hydrochloride

There total 7 articles about 3-Butenylamine hydrochloride 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: 100.0%

N-(3-butenyl)phthalimide (52898-32-5) → but-3-en-1-amine hydrochloride (17875-18-2)

Guidance literature:

N-(3-butenyl)phthalimide; With hydrazine hydrate; In ethanol; at 50 ℃; for 1.03333h; Inert atmosphere;

With hydrogenchloride; In water; at 20 ℃; for 0.216667h;

DOI:10.1021/acs.joc.5b01301

Reference yield: 96.0%

homoalylic alcohol (627-27-0) → but-3-en-1-amine hydrochloride (17875-18-2)

Guidance literature:

homoalylic alcohol; With phthalimide; di-isopropyl azodicarboxylate; triphenylphosphine; In tetrahydrofuran; at 0 ℃; for 3h; Mitsunobu reaction;

With hydrazine; In ethanol; water; at 80 ℃;

DOI:10.3987/COM-05-S(T)65

Reference yield: 54.0%

C11H21BN(1-)*H(1+) → but-3-en-1-amine hydrochloride (17875-18-2)

Guidance literature:

With hydrogenchloride; formaldehyd; ammonia; In 1,4-dioxane; methanol; at 55 ℃; for 72h; Sealed tube;

DOI:10.1039/c8ob02152j

upstream raw materials:

4-azido-1-butene

1-buten-3

N-(3-butenyl)phthalimide

homoalylic alcohol

Downstream raw materials:

5-(but-3-enyl)-1,3-dibenzylhexahydro-2-oxo-1,3,5-triazine

N-(but-3-en-1-yl)benzamide

2-ethenyl-N-3-butenyl-benzeneethaneamine

2-ethenyl-4,5-dimethoxy-N-3-butenyl-benzenenemethanamine