3-Bromo-1H-indazole-6-carboxylic acid

Base Information

Chemical Name:3-Bromo-1H-indazole-6-carboxylic acid
CAS No.:114086-30-5
Molecular Formula:C₈H₅BrN₂O₂
Molecular Weight:241.044
Hs Code.:2933990090
European Community (EC) Number:894-024-6
ChEMBL ID:CHEMBL4875365
DSSTox Substance ID:DTXSID00600807
Wikidata:Q82497081
Mol file:114086-30-5.mol

Synonyms:3-Bromo-1H-indazole-6-carboxylic acid;114086-30-5;3-bromo-2H-indazole-6-carboxylic acid;1H-Indazole-6-carboxylic acid, 3-bromo-;3-BROMO (1H) INDAZOLE CARBOXYLIC ACID;CHEMBL4875365;1h-indazole-6-carboxylic acid,3-bromo-;3-Bromo-6-carboxyindazole;SCHEMBL9818232;DTXSID00600807;PKOJMSAMIIFLSC-UHFFFAOYSA-N;AMY31656;BDBM50578101;MFCD09263248;3-Bromo-1H-indazole-6-carboxylicacid;AKOS022172004;AS-9376;PB14693;DB-060583;CS-0051497;EN300-316893;P10712

Suppliers and Price of 3-Bromo-1H-indazole-6-carboxylic acid

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-Bromo-1H-indazole-6-carboxylicAcid
500mg
$ 100.00

SynQuest Laboratories
3-Bromo-1H-indazole-6-carboxylic acid
5 g
$ 314.00

SynQuest Laboratories
3-Bromo-1H-indazole-6-carboxylic acid
1 g
$ 96.00

Matrix Scientific
3-Bromo-1H-indazole-6-carboxylicacid 95+%
1g
$ 182.00

Chemenu
3-Bromo-1H-indazole-6-carboxylicacid 95%
10g
$ 666.00

Chemcia Scientific
3-Bromo-1H-indazole-6-carboxylicacid 95%
1 G
$ 140.00

Apolloscientific
3-Bromo-1H-indazole-6-carboxylic acid
5g
$ 265.00

Apolloscientific
3-Bromo-1H-indazole-6-carboxylic acid
1g
$ 82.00

Total 17 raw suppliers

Chemical Property of 3-Bromo-1H-indazole-6-carboxylic acid

Chemical Property:

Boiling Point:493.4±25.0 °C(Predicted)
PKA:3.79±0.30(Predicted)
PSA：65.98000
Density:1.946±0.06 g/cm3(Predicted)
LogP:2.02360
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:239.95344
Heavy Atom Count:13
Complexity:224

Purity/Quality:

99%, ^*data from raw suppliers

3-Bromo-1H-indazole-6-carboxylicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC2=C(NN=C2C=C1C(=O)O)Br
Uses 3-Bromo-1H-indazole-6-carboxylic Acid is used in preparation of bicyclic compounds as 15-PGDH inhibitors.

Technology Process of 3-Bromo-1H-indazole-6-carboxylic acid

There total 1 articles about 3-Bromo-1H-indazole-6-carboxylic acid 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: 99.0%

: 704-91-6
1H-indazole-6-carboxylic acid

: 114086-30-5
3-bromo-1H-indazole-6-carboxylic acid

Guidance literature:: With bromine; sodium hydrogensulfite; In acetic acid;

Reference yield:

: 114086-30-5
3-bromo-1H-indazole-6-carboxylic acid

: 1386457-24-4
3-bromo-1H-indazole-6-carboxylic acid benzyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: dmap; triethylamine / dichloromethane / 16 h / 25 °C

2: sodium iodide; caesium carbonate / N,N-dimethyl-formamide / 16 h / 20 °C

3: trifluoroacetic acid / dichloromethane / 16 h / 20 °C

With dmap; caesium carbonate; triethylamine; trifluoroacetic acid; sodium iodide; In dichloromethane; N,N-dimethyl-formamide;

Reference yield:

: 114086-30-5
3-bromo-1H-indazole-6-carboxylic acid

: 1386457-25-5
3-bromo-indazole-1,6-dicarboxylic acid 6-benzyl ester 1-tert-butyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: dmap; triethylamine / dichloromethane / 16 h / 25 °C

2: sodium iodide; caesium carbonate / N,N-dimethyl-formamide / 16 h / 20 °C

With dmap; caesium carbonate; triethylamine; sodium iodide; In dichloromethane; N,N-dimethyl-formamide;