3-Hydroxycarbamazepine

Base Information

Chemical Name:3-Hydroxycarbamazepine
CAS No.:68011-67-6
Molecular Formula:C₁₅H₁₂N₂O₂
Molecular Weight:252.272
Hs Code.:
European Community (EC) Number:809-495-5
UNII:PDG5O25MKO
DSSTox Substance ID:DTXSID80218202
Nikkaji Number:J620.202K
Wikidata:Q27149641
ChEMBL ID:CHEMBL3103395
Mol file:68011-67-6.mol

Synonyms:3-hydroxycarbamazepine;3OHCBZ

Suppliers and Price of 3-Hydroxycarbamazepine

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

Medical Isotopes, Inc.
3-HydroxyCarbamazepine
5 mg
$ 2800.00

Medical Isotopes, Inc.
3-HydroxyCarbamazepine
1 mg
$ 975.00

American Custom Chemicals Corporation
3-HYDROXY CARBAMAZEPINE 95.00%
0.5MG
$ 493.00

Total 11 raw suppliers

Chemical Property of 3-Hydroxycarbamazepine

Chemical Property:

Vapor Pressure:4.04E-10mmHg at 25°C
Melting Point:240-242°C
Refractive Index:1.7
Boiling Point:487.3 °C at 760 mmHg
Flash Point:248.5 °C
PSA：66.56000
Density:1.363 g/cm³
LogP:3.85810
Storage Temp.:-20°C Freezer
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:252.089877630
Heavy Atom Count:19
Complexity:382

Purity/Quality:

99% ^*data from raw suppliers

3-HydroxyCarbamazepine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C=CC3=C(N2C(=O)N)C=C(C=C3)O

Technology Process of 3-Hydroxycarbamazepine

There total 5 articles about 3-Hydroxycarbamazepine 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: 37.0%

: 92483-76-6
3-methoxy-5H-dibenz[b,f]azepine-5-carboxamide

: 68011-67-6
3-Hydroxycarbamazepine

Guidance literature:: With boron tribromide; In tetrahydrofuran; at 0 - 20 ℃; for 50h;
DOI:10.1016/j.bmc.2013.12.035

Reference yield:

: 298-46-4
carbamazepin

: 68011-67-6
3-Hydroxycarbamazepine

Guidance literature:: With Vitamin C; Agrocybe aegerita peroxygenase; dihydrogen peroxide; at 20 ℃; pH=7; regioselective reaction; aq. phosphate buffer; Enzymatic reaction;
DOI:10.1016/j.bcp.2011.06.020

Reference yield:

: 92483-74-4
3-methoxy-5H-dibenz[b,f]azepine

: 68011-67-6
3-Hydroxycarbamazepine

Guidance literature:: Multi-step reaction with 2 steps

1: acetic acid / 2 h / 70 °C

2: boron tribromide / tetrahydrofuran / 50 h / 0 - 20 °C

With boron tribromide; acetic acid; In tetrahydrofuran;
DOI:10.1016/j.bmc.2013.12.035