5-Hydroxyxanthotoxin

Base Information

Chemical Name:5-Hydroxyxanthotoxin
CAS No.:7471-73-0
Molecular Formula:C₁₂H₈O₅
Molecular Weight:232.193
Hs Code.:
NSC Number:401277
DSSTox Substance ID:DTXSID70419640
Nikkaji Number:J493.551I
Wikidata:Q3599225
Metabolomics Workbench ID:52883
Mol file:7471-73-0.mol

Synonyms:5-hydroxy-8-methoxypsoralen

Suppliers and Price of 5-Hydroxyxanthotoxin

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
5-Hydroxyxanthotoxin
1mg
$ 165.00

Total 13 raw suppliers

Chemical Property of 5-Hydroxyxanthotoxin

Chemical Property:

Vapor Pressure:3.73E-05mmHg at 25°C
Boiling Point:342.7oC at 760 mmHg
Flash Point:161.1oC
PSA：72.81000
Density:1.484g/cm3
LogP:2.25340
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:232.03717335
Heavy Atom Count:17
Complexity:353

Purity/Quality:

≥98% ^*data from raw suppliers

5-Hydroxyxanthotoxin ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=C2C(=C(C3=C1OC=C3)O)C=CC(=O)O2
Uses 5-Hydroxyxanthotoxin is from the root bark of Changium smyrnioides that exhibits inhibitory and anti-tumor effects.

Technology Process of 5-Hydroxyxanthotoxin

There total 4 articles about 5-Hydroxyxanthotoxin 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:

: 49739-65-3
4-amino-9-methoxy-7H-furo<3,2-g><1>benzopyran-7-one

: 7471-73-0
5-hydroxy-8-methoxypsoralen

Guidance literature:: With hydrogenchloride; sodium nitrite;
DOI:10.1021/jo01098a023

Reference yield:

: 298-81-7
9-methoxy-7H-furo[3,2-g][1]benzopyran-7-one

: 7471-73-0
5-hydroxy-8-methoxypsoralen

Guidance literature:: Multi-step reaction with 3 steps

1: acetic acid; aqueous nitric acid

2: aq.-ethanolic hydrochloric acid; tin; tin (II)-chloride

3: aqueous methanol. hydrochloric acid; sodium nitrite

With hydrogenchloride; tin; nitric acid; acetic acid; tin(ll) chloride; sodium nitrite;
DOI:10.1021/jo01098a023

Reference yield:

: 1930-56-9
4-nitro-9-methoxy-7H-furo<3,2-g><1>benzopyran-7-one

: 7471-73-0
5-hydroxy-8-methoxypsoralen

Guidance literature:: Multi-step reaction with 2 steps

1: aq.-ethanolic hydrochloric acid; tin; tin (II)-chloride

2: aqueous methanol. hydrochloric acid; sodium nitrite

With hydrogenchloride; tin; tin(ll) chloride; sodium nitrite;
DOI:10.1021/jo01098a023