4-amino-N-(furan-2-ylmethyl)benzenesulfonamide

Base Information

• Chemical Name: 4-amino-N-(furan-2-ylmethyl)benzenesulfonamide
• CAS No.: 5626-92-6
• Molecular Formula: C₁₁H₁₂N₂O₃S
• Molecular Weight: 252.294
• Hs Code.: 2935009090
• European Community (EC) Number: 835-434-7
• DSSTox Substance ID: DTXSID70366069
• Wikidata: Q82151140
• Mol file: 5626-92-6.mol

Synonyms:5626-92-6;4-amino-N-(furan-2-ylmethyl)benzenesulfonamide;4-Amino-N-furan-2-ylmethyl-benzenesulfonamide;4-amino-N-(2-furylmethyl)benzenesulfonamide;4-AMINO-N-FURAN-2-YL-METHYLBENZENESULFONAMIDE;MFCD02223638;4-amino-N-[(furan-2-yl)methyl]benzene-1-sulfonamide;Oprea1_010574;Oprea1_853175;DTXSID70366069;HMS1617I06;BBL036316;STK500279;AKOS000122145;CCG-116617;SB61321;VS-13417;4-amino-n-furan-2-ylmethylbenzenesulfonamide;CS-0218852;EU-0017037;FT-0635790;EN300-02201;4-amino-N-(furan-2-ylmethyl)benzene-1-sulfonamide;Z56792393;4-Amino-N-(2-furylmethyl)benzenesulfonamide, AldrichCPR

Chemical Property of 4-amino-N-(furan-2-ylmethyl)benzenesulfonamide

Chemical Property:

• Vapor Pressure: 1.89E-08mmHg at 25°C
• Melting Point: 153 °C(Solv: water (7732-18-5))
• Refractive Index: 1.612
• Boiling Point: 454.5 °C at 760 mmHg
• PKA: 11.18±0.50(Predicted)
• Flash Point: 228.7 °C
• PSA: 93.71000
• Density: 1.357g/cm³
• LogP: 3.39320
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 252.05686342
• Heavy Atom Count: 17
• Complexity: 331

Purity/Quality:

98%min ^*data from raw suppliers

4-Amino-N-(2-furylmethyl)benzenesulfonamide Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=COC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)N

Technology Process of 4-amino-N-(furan-2-ylmethyl)benzenesulfonamide

There total 4 articles about 4-amino-N-(furan-2-ylmethyl)benzenesulfonamide 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:

furan-2-ylmethanamine (617-89-0) → 4-amino-N-(furan-2-ylmethyl)benzenesulfonamide (5626-92-6)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium hydrogencarbonate; acetone

2: aq. NaOH solution

With sodium hydroxide; sodium hydrogencarbonate; acetone;

Reference yield:

4-Nitrobenzenesulfonyl chloride (98-74-8) → 4-amino-N-(furan-2-ylmethyl)benzenesulfonamide (5626-92-6)

Guidance literature:

Multi-step reaction with 2 steps

1: pyridine / dichloromethane / 5 h / Reflux

2: hydrogenchloride; tin / ethanol; water / Reflux

With pyridine; hydrogenchloride; tin; In ethanol; dichloromethane; water;

DOI:10.1016/j.ejmech.2015.10.050

Reference yield:

N-acetyl-sulfanilic acid furfurylamide (321531-94-6) → 4-amino-N-(furan-2-ylmethyl)benzenesulfonamide (5626-92-6)

Guidance literature:

With sodium hydroxide;

upstream raw materials:

N-acetyl-sulfanilic acid furfurylamide

furan-2-ylmethanamine

p-acetylaminobenzenesulfonyl chloride

4-Nitrobenzenesulfonyl chloride

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