Butanilicaine

Base Information

• Chemical Name: Butanilicaine
• CAS No.: 3785-21-5
• Molecular Formula: C₁₃H₁₉ClN₂O
• Molecular Weight: 254.76
• Hs Code.: 2924299090
• UNII: 7X3WV51F4N
• DSSTox Substance ID: DTXSID90191279
• Nikkaji Number: J8.254F
• Wikipedia: Butanilicaine
• Wikidata: Q5002356
• NCI Thesaurus Code: C96327
• Metabolomics Workbench ID: 58879
• ChEMBL ID: CHEMBL2104238
• Mol file: 3785-21-5.mol

Synonyms:butanilicaine;butanilicaine monohydrochloride;butanilicaine phosphate;butanilicaine phosphate (1:1);Hostacaine

Chemical Property of Butanilicaine

Chemical Property:

• Appearance/Colour: White crystalline powder
• Vapor Pressure: 2.88E-06mmHg at 25°C
• Melting Point: 45-46oC
• Refractive Index: 1.554
• Boiling Point: 389.3 °C at 760 mmHg
• PKA: 13.41±0.70(Predicted)
• Flash Point: 189.2 °C
• PSA: 41.13000
• Density: 1.129 g/cm3
• LogP: 4.24250
• Storage Temp.: Refrigerator
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 254.1185909
• Heavy Atom Count: 17
• Complexity: 236

Purity/Quality:

99% ^*data from raw suppliers

2-(BUTYLAMINO)-6-CHLORO-O-ACETOLUIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCNCC(=O)NC1=C(C=CC=C1Cl)C
• Uses: Butanilicaine Hydrochloride, is a local anesthetic.
• Therapeutic Function: Local anesthetic

Technology Process of Butanilicaine

There total 4 articles about Butanilicaine 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:

2-chloro-N-(2-chloro-6-methylphenyl)acetamide (6307-67-1) + N-butylamine (109-73-9,85404-21-3) → 2-(butylamino)-N-(2-chloro-6-methylphenyl)acetamide (3785-21-5)

Guidance literature:

DOI:10.1021/ja01541a028

Reference yield:

2-chloro-6-methylaniline (87-63-8) → 2-(butylamino)-N-(2-chloro-6-methylphenyl)acetamide (3785-21-5)

Guidance literature:

DOI:10.1021/ja01541a028

Reference yield:

Butylaminoessigsaeurechlorid + 2-chloro-6-methylaniline (87-63-8) → 2-(butylamino)-N-(2-chloro-6-methylphenyl)acetamide (3785-21-5)

Guidance literature:

upstream raw materials:

2-chloro-N-(2-chloro-6-methylphenyl)acetamide

N-butylamine

2-chloro-6-methylaniline