1-Propylnaphthalene

Base Information

• Chemical Name: 1-Propylnaphthalene
• CAS No.: 2765-18-6
• Molecular Formula: C13H14
• Molecular Weight: 170.254
• Hs Code.: 2902909090
• European Community (EC) Number: 220-436-7
• UNII: 14F18XM77Q
• DSSTox Substance ID: DTXSID40871877
• Nikkaji Number: J191.466I
• Wikidata: Q27251619
• Mol file: 2765-18-6.mol

Synonyms:1-Propylnaphthalene;2765-18-6;Naphthalene, 1-propyl-;Propylnaphthalene;1-N-propylnaphthalene;NAPHTHALENE, PROPYL-;KSK 260;UNII-14F18XM77Q;14F18XM77Q;EINECS 220-436-7;27378-74-1;1-propyl-naphthalene;1-Propylnaphthalene #;DTXSID40871877;AKOS006273057;LS-94822;FT-0691166;A856572;Q27251619

Chemical Property of 1-Propylnaphthalene

Chemical Property:

• Vapor Pressure: 0.00864mmHg at 25°C
• Melting Point: -8.6°C
• Refractive Index: 1.5901
• Boiling Point: 275.3°Cat760mmHg
• Flash Point: 118.9°C
• PSA: 0.00000
• Density: 0.984g/cm³
• LogP: 3.79230
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 170.109550447
• Heavy Atom Count: 13
• Complexity: 150

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1=CC=CC2=CC=CC=C21

Technology Process of 1-Propylnaphthalene

There total 26 articles about 1-Propylnaphthalene 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: 96.0%

1-allylnaphthalene (2489-86-3) → 1-n-propylnaphthalene (2765-18-6)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In tetrahydrofuran; at 20 ℃; for 12h; under 760.051 Torr;

DOI:10.2174/1573406412666160915163002

Reference yield: 93.0%

methanol (67-56-1) + 1-naphthylmethyl propanoate (13098-90-3) → 1-n-propylnaphthalene (2765-18-6) + 1-(methoxymethyl)naphthalene (5903-23-1) + propionic acid (802294-64-0,79-09-4)

Guidance literature:

at 20 ℃; Rate constant; Quantum yield; Irradiation;

DOI:10.1021/ja00007a049

Reference yield: 90.0%

propylboronic acid (17745-45-8) + naphthalen-1-yl 2,3,4,5,6-pentafluorobenzenesulfonate → 1-n-propylnaphthalene (2765-18-6)

Guidance literature:

With potassium phosphate monohydrate; palladium diacetate; XPhos; In tert-butyl alcohol; at 50 ℃; for 12h; Schlenk technique; Inert atmosphere; Sealed tube;

DOI:10.1016/j.tetlet.2015.07.033

upstream raw materials:

1-propenyl-naphthalene

1-allylnaphthalene

1-naphthyl ethyl ketone

ethene

Downstream raw materials:

1-(2-Butyl)-5-(3-pentyl)-naphthalin

4-propyl-1-naphthoic acid

4-propyl-[1]naphthylamine

3-(1-naphthyl)pentane

Refernces

• 1、 Chen, Kai,Chen, Wei,Yi, Xiaofei,Chen, Wanzhi,Liu, Miaochang,Wu, Huayue. "Sterically hindered N-heterocyclic carbene/palladium(ii) catalyzed Suzuki-Miyaura coupling of nitrobenzenes". supporting information. p. 9287 - 9290. Retrieved 2019/08/08.
• 2、 Joseph, Jayan T.,Sajith, Ayyiliath M.,Ningegowda, Revanna C.,Nagaraj, Archana,Rangappa,Shashikanth, Sheena. "Aryl/heteroaryl pentafluorobenzenesulfonates (ArOPFBs): New electrophilic coupling partners for room temperature Suzuki-Miyaura cross-coupling reactions". . p. 5106 - 5111. Retrieved 2015/08/06.