(+)-Mellein

Base Information

Chemical Name:(+)-Mellein
CAS No.:62623-84-1
Molecular Formula:C₁₀H₁₀O₃
Molecular Weight:178.188
Hs Code.:
DSSTox Substance ID:DTXSID10448358
Nikkaji Number:J827.450I
Metabolomics Workbench ID:170419
ChEMBL ID:CHEMBL4438912
Mol file:62623-84-1.mol

Synonyms:(+)-Mellein;62623-84-1;CHEMBL4438912;(3S)-8-hydroxy-3-methyl-3,4-dihydroisochromen-1-one;1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-methyl-, (S)-;SCHEMBL13925627;DTXSID10448358;BDBM50524012;AKOS040762036;(R,S)-8-Hydroxy-3-methyl-isochroman-1-one;EN300-25695279;(3S)-8-hydroxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one

Suppliers and Price of (+)-Mellein

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

Crysdot
(+)-Mellein 95+%
5mg
$ 436.00

Total 12 raw suppliers

Chemical Property of (+)-Mellein

Chemical Property:

Boiling Point:392.7±42.0 °C(Predicted)
PKA:9.86±0.40(Predicted)
PSA：46.53000
Density:1.252±0.06 g/cm3(Predicted)
LogP:1.49360
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:0
Exact Mass:178.062994177
Heavy Atom Count:13
Complexity:214

Purity/Quality:

Analysis control 96% ^*data from raw suppliers

(+)-Mellein 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1CC2=C(C(=CC=C2)O)C(=O)O1
Isomeric SMILES:C[C@H]1CC2=C(C(=CC=C2)O)C(=O)O1

Technology Process of (+)-Mellein

There total 32 articles about (+)-Mellein 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: 98.0%