3-Chloroisoquinolin-4-OL

Base Information

Chemical Name:3-Chloroisoquinolin-4-OL
CAS No.:101774-33-8
Molecular Formula:C9H6ClNO
Molecular Weight:179.6
Hs Code.:2933499090
DSSTox Substance ID:DTXSID30697447
Wikidata:Q82627348
Mol file:101774-33-8.mol

Synonyms:3-CHLOROISOQUINOLIN-4-OL;101774-33-8;3-chloro-4-hydroxyisoquinoline;CL1036;3-Chloro-4-isoquinolinol;DTXSID30697447;BEA77433;MFCD11846288;BS-19119;CS-0200037;A925668

Suppliers and Price of 3-Chloroisoquinolin-4-OL

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
3-Chloroisoquinolin-4-ol
10mg
$ 45.00

TRC
3-Chloroisoquinolin-4-ol
100mg
$ 240.00

Crysdot
3-Chloroisoquinolin-4-ol 95+%
5g
$ 1469.00

Crysdot
3-Chloroisoquinolin-4-ol 95+%
1g
$ 490.00

Chemenu
3-chloroisoquinolin-4-ol 95%
5g
$ 1374.00

Chemenu
3-chloroisoquinolin-4-ol 95%
1g
$ 458.00

AstaTech
3-CHLOROISOQUINOLIN-4-OL 97%
1 / G
$ 441.00

AstaTech
3-CHLOROISOQUINOLIN-4-OL 97%
0.25 / G
$ 176.00

AstaTech
3-CHLOROISOQUINOLIN-4-OL 97%
5 / G
$ 1322.00

Alichem
3-Chloroisoquinolin-4-ol
1g
$ 494.90

Total 13 raw suppliers

Chemical Property of 3-Chloroisoquinolin-4-OL

Chemical Property:

Melting Point:168.5-169.5 °C (decomp)
Boiling Point:425.6±25.0 °C(Predicted)
PKA:5.26±0.50(Predicted)
PSA：33.12000
Density:1.412±0.06 g/cm3(Predicted)
LogP:2.59380
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:179.0137915
Heavy Atom Count:12
Complexity:165

Purity/Quality:

97% ^*data from raw suppliers

3-Chloroisoquinolin-4-ol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C=NC(=C2O)Cl

Technology Process of 3-Chloroisoquinolin-4-OL

There total 4 articles about 3-Chloroisoquinolin-4-OL 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:

: 3336-49-0
4-isoquinolinol

: 101774-33-8
3-chloro-4-hydroxyisoquinoline

Guidance literature:: With Escherichia coli BL₂₁-CodonPlus (DE₃)-RIL/pJZ₅₄; Enzymatic reaction;
DOI:10.1016/j.bmcl.2012.12.038

Reference yield:

: 99973-50-9
acetic acid-(3-chloro-[4]isoquinolyl ester)

: 101774-33-8
3-chloro-4-hydroxyisoquinoline

Guidance literature:: With sodium hydroxide; water;
DOI:10.1021/ja01546a060

Reference yield:

: 19493-45-9
3-chloroisoquinoline

: 101774-33-8
3-chloro-4-hydroxyisoquinoline

Guidance literature:: Multi-step reaction with 3 steps

1: acetic acid; aqueous hydrogen peroxide

3: NaOH-solution; water

With sodium hydroxide; water; dihydrogen peroxide; acetic acid;
DOI:10.1021/ja01546a060