8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione

Base Information

Chemical Name:8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione
CAS No.:240423-23-8
Molecular Formula:C20H26O4
Molecular Weight:330
Hs Code.:
UNII:72F2HK78GM
DSSTox Substance ID:DTXSID50438718
Nikkaji Number:J1.185.369B
ChEMBL ID:CHEMBL90715
Mol file:240423-23-8.mol

Synonyms:salvicine

Suppliers and Price of 8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione

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

Matrix Scientific
8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione 95%
5g
$ 2960.00

Matrix Scientific
8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione 95%
1g
$ 1203.00

Arctom
Salvicine ≥98%
5mg
$ 468.00

Total 11 raw suppliers

Chemical Property of 8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione

Chemical Property:

Boiling Point:516.6±50.0 °C(Predicted)
PKA:14.62±0.29(Predicted)
PSA：74.60000
Density:1.166±0.06 g/cm3(Predicted)
LogP:2.86420
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:330.18310931
Heavy Atom Count:24
Complexity:532

Purity/Quality:

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

8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C2=C(C=C1)C=C(C(=O)C2=O)C(C)C)CCC(C(C)(C)O)O
Uses 8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione is useful in the synthesis of analogs which exhibits potent cytotoxicity against tumor cells and topoisomerase II inhibitory effects.

Technology Process of 8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione

There total 2 articles about 8-(3,4-Dihydroxy-4-methylpentyl)-3-isopropyl-7-methylnaphthalene-1,2-dione 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: 92.0%

: 102607-41-0
4,5-seco-5,10-friedo-Abieta-3,5⁽¹⁰⁾,6,8,13-pentaene-11,12-dione

: 240423-23-8
4,5-seco-5,10-friedo-abieta-3,4-dihydroxy-5⁽¹⁰⁾,6,8,13-tetraene-11,12-dione

Guidance literature:: 4,5-seco-5,10-friedo-Abieta-3,5⁽¹⁰⁾,6,8,13-pentaene-11,12-dione; With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 20 ℃;

With perchloric acid; In tetrahydrofuran; water; at 20 ℃; for 6h; Inert atmosphere;
DOI:10.3390/molecules25194494

Reference yield: 65.0%

: 240423-22-7
8-[2-(3,3-dimethyl-oxiranyl)-ethyl]-3-isopropyl-7-methyl-[1,2]naphthoquinone

: 240423-23-8
4,5-seco-5,10-friedo-abieta-3,4-dihydroxy-5⁽¹⁰⁾,6,8,13-tetraene-11,12-dione

Guidance literature:: With perchloric acid; In tetrahydrofuran; for 6h;
DOI:10.1016/S0960-894X(99)00472-2

Reference yield:

: 240423-23-8
4,5-seco-5,10-friedo-abieta-3,4-dihydroxy-5⁽¹⁰⁾,6,8,13-tetraene-11,12-dione

: N-(4-fluorophenyl)-3-(6-isopropyl-2-methyl-7,8-dioxo-7,8-dihydronaphthalen-1-yl)propanamide

Guidance literature:: Multi-step reaction with 2 steps

1: pyridinium chlorochromate / dichloromethane; water / 20 °C

2: N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate / N,N-dimethyl-formamide / 20 °C

With N-ethyl-N,N-diisopropylamine; pyridinium chlorochromate; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In dichloromethane; water; N,N-dimethyl-formamide;
DOI:10.3390/molecules25194494