6-(1-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic acid

Base Information

Chemical Name:6-(1-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic acid
CAS No.:153559-76-3
Deprecated CAS:197730-94-2,309956-42-1,262615-35-0,263723-53-1
Molecular Formula:C₂₄H₂₉NO₂
Molecular Weight:363.5
Hs Code.:
UNII:UVU4X1103P
DSSTox Substance ID:DTXSID90165354
Nikkaji Number:J668.732F
Wikidata:Q27080267
Pharos Ligand ID:PZYHM68ACLUJ
Metabolomics Workbench ID:146557
ChEMBL ID:CHEMBL288436
Mol file:153559-76-3.mol

Synonyms:6-(1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic acid;LG 100268;LG-100268;LG100268

Suppliers and Price of 6-(1-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic 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
LG100268
2mg
$ 75.00

Tocris
LG100268 ≥98%(HPLC)
5
$ 107.00

Tocris
LG100268 ≥98%(HPLC)
25
$ 413.00

Sigma-Aldrich
LG100268 ≥98% (HPLC)
5mg
$ 120.00

Sigma-Aldrich
LG100268 ≥98% (HPLC)
25mg
$ 476.00

Medical Isotopes, Inc.
LG100268
5 mg
$ 925.00

CSNpharm
LG100268
5mg
$ 93.00

ChemScene
LG100268 99.22%
100mg
$ 980.00

ChemScene
LG100268 99.22%
50mg
$ 580.00

ChemScene
LG100268 99.22%
10mg
$ 160.00

Total 9 raw suppliers

Chemical Property of 6-(1-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic acid

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Melting Point:275-277℃
Boiling Point:487°Cat760mmHg
PKA:2.35±0.10(Predicted)
Flash Point:248.3°C
PSA：50.19000
Density:1.115g/cm³
LogP:5.51710
Storage Temp.:-20°C Freezer
Solubility.:DMSO: ≥5mg/mL (warmed)
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:363.219829168
Heavy Atom Count:27
Complexity:591

Purity/Quality:

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

LG100268 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC2=C(C=C1C3(CC3)C4=NC=C(C=C4)C(=O)O)C(CCC2(C)C)(C)C
Uses LG 100268 is a potent RXR agonist for evaluation in the treatment of non-insulin-dependent (type II) diabetes mellitus (NIDDM).

Technology Process of 6-(1-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic acid

There total 15 articles about 6-(1-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic 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: 99.0%

: 153559-50-3
methyl 6-<1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl>nicotinate

: 153559-76-3
6-(1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic acid

Guidance literature:: With sodium hydroxide; In methanol; at 60 - 70 ℃; for 2h;
DOI:10.1021/jo0103064

Reference yield: 95.0%

: 1347735-37-8
ethyl 6-(1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinate

: 153559-76-3
6-(1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic acid

Guidance literature:: With sodium hydroxide; In methanol; water; for 12h; Reflux;
DOI:10.1039/c4cc01757a

Reference yield:

: 6683-48-3
1,1,4,4,6-pentamethyl-1,2,3,4-tetrahydronaphthalene

: 153559-76-3
6-(1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclopropyl)nicotinic acid

Guidance literature:: Multi-step reaction with 4 steps

1: AlCl₃ / CH₂Cl₂; nitromethane / 24 h / 15 - 30 °C

2: NaNH₂ / tetrahydrofuran

3: 65 percent / Et₂Zn / CH₂Cl₂

4: 99 percent / aq. NaOH / methanol / 2 h / 60 - 70 °C

With sodium hydroxide; aluminium trichloride; diethylzinc; sodium amide; In tetrahydrofuran; methanol; nitromethane; dichloromethane; 1: Friedel-Crafts acylation / 2: Wittig reaction;
DOI:10.1021/jo0103064