[(5,5-Dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid

Base Information

Chemical Name:[(5,5-Dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid
CAS No.:93742-43-9
Molecular Formula:C₉H₁₀N₄O
Molecular Weight:190.205
Hs Code.:2933990090
NSC Number:98492
DSSTox Substance ID:DTXSID40918175
Wikidata:Q82890129
Mol file:93742-43-9.mol

Synonyms:92864-05-6;2-((5,5-Dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy)acetic acid;[(5,5-dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid;2-[(5,5-dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid;NSC98492;DTXSID40918175;NSC-98492

Suppliers and Price of [(5,5-Dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
2-(5-phenyl-2H-tetrazol-2-yl)ethanol
100mg
$ 60.00

ChemBridge Corporation
2-(5-phenyl-2H-tetrazol-2-yl)ethanol 95%
5 g
$ 205.00

ChemBridge Corporation
2-(5-phenyl-2H-tetrazol-2-yl)ethanol 95%
1 g
$ 70.00

American Custom Chemicals Corporation
2-(5-PHENYL-2H-TETRAZOL-2-YL)ETHANOL 95.00%
5MG
$ 501.73

Total 6 raw suppliers

Chemical Property of [(5,5-Dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid

Chemical Property:

Vapor Pressure:4.14E-07mmHg at 25°C
Boiling Point:399.8oC at 760 mmHg
Flash Point:195.6oC
PSA：63.83000
Density:1.33g/cm3
LogP:0.33240
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:234.125594432
Heavy Atom Count:17
Complexity:285

Purity/Quality:

98% ^*data from raw suppliers

2-(5-phenyl-2H-tetrazol-2-yl)ethanol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CCCC2=C1C=CC=C2OCC(=O)O)C

Technology Process of [(5,5-Dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid

There total 6 articles about [(5,5-Dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)oxy]acetic acid 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: 70.0%

: 75-21-8,99932-75-9
oxirane

: 18039-42-4,3999-10-8
5-Phenyl-1H-tetrazole

: 93742-43-9
2-(β-hydroxyethyl)-5-phenyltetrazole

: 83576-14-1
1-(β-hydroxyethyl)-5-phenyltetrazole

Guidance literature:: With sodium hydroxide; In ethanol; for 4h; Ambient temperature;
DOI:10.1007/BF00512828

Reference yield:

: 18039-42-4
5-phenyl-2H-1,2,3,4-tetrazole

: 540-51-2
2-bromoethanol

: 93742-43-9
2-(β-hydroxyethyl)-5-phenyltetrazole

Guidance literature:: With potassium hydroxide; Yield given. Multistep reaction; 1.) 1-propanol, 80 deg C, 1 h, 2.) 1-propanol, reflux, 1 d;
DOI:10.1021/jm00024a006

Reference yield:

: 93742-50-8
1-(2-ethoxycarbonyl-2-hydroxy-1-phenylethyl)-5-phenyltetrazole

: 93742-43-9
2-(β-hydroxyethyl)-5-phenyltetrazole

Guidance literature:: Multi-step reaction with 3 steps

1: 26 percent / methyltriphenylphosphonium iodide / hexamethylphosphoric acid triamide / 10 h

2: sodium ethoxide / ethanol / 0.75 h

3: 1.) tri-n-butylstannyl oxide / 1.) ethanol, reflux, 2 h, 2.) ether, 3 d, RT

With sodium ethanolate; methyl-triphenylphosphonium iodide; bis(tri-n-butyltin)oxide; In N,N,N,N,N,N-hexamethylphosphoric triamide; ethanol;