2-sec-Butylamino-3-chloro-1,4-naphthoquinone

Base Information

• Chemical Name: 2-sec-Butylamino-3-chloro-1,4-naphthoquinone
• CAS No.: 22272-32-8
• Molecular Formula: C₁₄H₁₄ClNO₂
• Molecular Weight: 263.724
• Hs Code.: 2922399090
• NSC Number: 91103
• Nikkaji Number: J42.451J
• Mol file: 22272-32-8.mol

Synonyms:2-sec-Butylamino-3-chloro-1,4-naphthoquinone;22272-32-8;NSC 91103;BRN 3093349;1,4-NAPHTHOQUINONE, 2-(sec-BUTYLAMINO)-3-CHLORO-;NSC91103;1, 2-(sec-butylamino)-3-chloro-;NSC-91103;WLN: L66 BV EVJ CMY2&1 DG;LS-95623;2-(sec-Butylamino)-3-chloro-1,4-naphthoquinone

Chemical Property of 2-sec-Butylamino-3-chloro-1,4-naphthoquinone

Chemical Property:

• Vapor Pressure: 2.37E-05mmHg at 25°C
• Boiling Point: 359.5°C at 760 mmHg
• Flash Point: 171.2°C
• PSA: 46.17000
• Density: 1.26g/cm³
• LogP: 3.29500
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 263.0713064
• Heavy Atom Count: 18
• Complexity: 403

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)NC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

Technology Process of 2-sec-Butylamino-3-chloro-1,4-naphthoquinone

There total 2 articles about 2-sec-Butylamino-3-chloro-1,4-naphthoquinone 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: 99.0%

2,3-Dichloro-1,4-naphthoquinone (117-80-6) + SEC-BUTYLAMINE (33966-50-6) → 2-(sec-butylamino)-3-chloronaphthalene-1,4-dione (22272-32-8)

Guidance literature:

In ethanol; at 20 ℃; for 1h;

DOI:10.1021/acs.jmedchem.1c01383

Reference yield:

→ 2-(sec-butylamino)-3-chloronaphthalene-1,4-dione (22272-32-8)

Guidance literature:

aus 2,3-Dichlor-1,4-naphthochinon, sek.-Butylamin;

DOI:10.1021/jm00301a053

upstream raw materials:

2,3-Dichloro-1,4-naphthoquinone

SEC-BUTYLAMINE

Refernces