9-(2-Ethylhexyl)carbazole

Base Information

• Chemical Name: 9-(2-Ethylhexyl)carbazole
• CAS No.: 187148-77-2
• Molecular Formula: C20H25 N
• Molecular Weight: 279.425
• European Community (EC) Number: 623-185-5
• DSSTox Substance ID: DTXSID20584610
• Nikkaji Number: J671.649K
• Mol file: 187148-77-2.mol

Synonyms:9-(2-Ethylhexyl)carbazole;187148-77-2;9-(2-ETHYLHEXYL)-9H-CARBAZOLE;9-(2-ETHYLHEXYL)CARBAZOLE 97;N-(2-Ethylhexyl)carbazole;9H-Carbazole,9-(2-ethylhexyl)-;SCHEMBL1979951;DTXSID20584610;SAXNQWFLHXTRDI-UHFFFAOYSA-N;9-(2-ethyl-hexyl)-9H-carbazole;9-(2-Ethylhexyl)carbazole, 97%;MFCD06798127;BS-44132;E0972;T71997;J-012041

Chemical Property of 9-(2-Ethylhexyl)carbazole

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: n20/D 1.5949(lit.)
• Boiling Point: 40 °C3 mm Hg(lit.)
• Flash Point: >230 °F
• PSA: 4.93000
• Density: 1.004 g/mL at 25 °C(lit.)
• LogP: 6.01090
• Water Solubility.: Soluble in water
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 6
• Exact Mass: 279.198699802
• Heavy Atom Count: 21
• Complexity: 291

Purity/Quality:

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

9-(2-Ethylhexyl)carbazole ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCC(CC)CN1C2=CC=CC=C2C3=CC=CC=C31

Technology Process of 9-(2-Ethylhexyl)carbazole

There total 1 articles about 9-(2-Ethylhexyl)carbazole 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: 48.0%

tris(2-ethylhexyl) phosphite (301-13-3) + 2-nitrobiphenyl (86-00-0) → 9H-carbazole (86-74-8,105184-46-1,97960-57-1) + N-(2-ethylhexyl)carbazole (187148-77-2)

Guidance literature:

With 1-methyl-4-nitrobenzene; at 160 ℃; for 17h; Inert atmosphere;

DOI:10.1016/j.tet.2012.04.044

Reference yield: 93.0%

N-(2-ethylhexyl)carbazole (187148-77-2) → 3,6-dibromo-9-(2-ethyl-hexyl)-9H-carbazole (173063-52-0)

Guidance literature:

With N-Bromosuccinimide; In N,N-dimethyl-formamide; at 0 - 20 ℃; Inert atmosphere;

DOI:10.1021/acs.inorgchem.0c02366

Reference yield: 78.0%

4-methoxy-benzoyl chloride (100-07-2) + N-(2-ethylhexyl)carbazole (187148-77-2) → C28H31NO2

Guidance literature:

With aluminum (III) chloride; In dichloromethane; at 0 ℃; for 0.5h; Temperature; Solvent; Time;

upstream raw materials:

tris(2-ethylhexyl) phosphite

2-nitrobiphenyl

Downstream raw materials:

9-(2-ethylhexyl)-9H-carbazole-3,6-dicarbaldehyde

[9-(2-ethyl-hexyl)-9H-carbazol-3-yl]-phenyl-methanone

C₃₁H₃₃NO₄

C₃₉H₄₅NO₈