tert-Butyl 5-hydroxyisoindoline-2-carboxylate

Base Information

Chemical Name:tert-Butyl 5-hydroxyisoindoline-2-carboxylate
CAS No.:226070-47-9
Molecular Formula:C13H17NO3
Molecular Weight:235.283
Hs Code.:2933990090
European Community (EC) Number:818-009-0
DSSTox Substance ID:DTXSID20595322
Wikidata:Q82490316
Mol file:226070-47-9.mol

Synonyms:tert-Butyl 5-hydroxyisoindoline-2-carboxylate;226070-47-9;5-Hydroxy-1,3-dihydro-isoindole-2-carboxylic acid tert-butyl ester;N-BOC-5-HYDROXYISOINDOLINE;tert-butyl 5-hydroxy-1,3-dihydroisoindole-2-carboxylate;MFCD10700132;SCHEMBL1168098;SCHEMBL4192300;DTXSID20595322;QLHANXZSEULFFM-UHFFFAOYSA-N;BJA07047;AKOS015841288;CS-W005127;SB64177;AS-38086;DA-07927;SY251477;tert-Butyl5-hydroxyisoindoline-2-carboxylate;EN300-378118;Tert-butyl 5-hydroxy-isoindoline-2-carboxylate;2-(tert-butyloxycarbonyl)-5-hydroxy-2,3-dihydro-1H-isoindole;tert-Butyl 5-hydroxy-1,3-dihydro-2H-isoindole-2-carboxylate;tert-butyl 5-hydroxy-2,3-dihydro-1H-isoindole-2-carboxylate;tert-Butyl 5-hydroxy-1,3-dihydro-2H-isoindole-2-carboxylate, AldrichCPR

Suppliers and Price of tert-Butyl 5-hydroxyisoindoline-2-carboxylate

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

Matrix Scientific
5-Hydroxy-1,3-dihydro-isoindole-2-carboxylic acid tert-butyl ester 95%
1g
$ 833.00

Crysdot
tert-Butyl5-hydroxyisoindoline-2-carboxylate 95%
250mg
$ 262.00

Crysdot
tert-Butyl5-hydroxyisoindoline-2-carboxylate 95%
1g
$ 579.00

American Custom Chemicals Corporation
TERT-BUTYL-5-HYDROXYISOINDOLINE-2-CARBOXYLATE 95.00%
5MG
$ 497.26

Alichem
tert-Butyl5-hydroxyisoindoline-2-carboxylate
5g
$ 643.86

Alichem
tert-Butyl5-hydroxyisoindoline-2-carboxylate
1g
$ 585.00

Alichem
tert-Butyl5-hydroxyisoindoline-2-carboxylate
250mg
$ 275.60

AK Scientific
tert-Butyl5-hydroxyisoindoline-2-carboxylate
10g
$ 1391.00

Total 18 raw suppliers

Chemical Property of tert-Butyl 5-hydroxyisoindoline-2-carboxylate

Chemical Property:

PSA：49.77000
LogP:2.58080
Storage Temp.:2-8°C
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:235.12084340
Heavy Atom Count:17
Complexity:298

Purity/Quality:

97% ^*data from raw suppliers

5-Hydroxy-1,3-dihydro-isoindole-2-carboxylic acid tert-butyl ester 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1CC2=C(C1)C=C(C=C2)O
Uses tert-Butyl 5-Hydroxyisoindoline-2-carboxylate is used in preparation of resorcylate aminopyrazole compounds as Hsp90 inhibitors and uses thereof.

Technology Process of tert-Butyl 5-hydroxyisoindoline-2-carboxylate

There total 8 articles about tert-Butyl 5-hydroxyisoindoline-2-carboxylate 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: 92.0%

: 201940-08-1
5-bromo-1,3-dihydro-isoindole-2-carboxylic acid tert-butyl ester

: 226070-47-9
tert-butyl 5-hydroxyisoindoline-2-carboxylate

Guidance literature:: With copper acetylacetonate; N¹-(4-hydroxy-2,6-dimethylphenyl)-N²-(4-hydroxy-3,5-dimethylphenyl)oxalamide; water; In water; dimethyl sulfoxide; at 80 ℃; for 24h; Schlenk technique; Inert atmosphere;
DOI:10.1021/jacs.6b08114

Reference yield: 51.0%

: 105358-58-5
5-hydroxy-isoindoline hydrobromide

: 24424-99-5
di-tert-butyl dicarbonate

: 226070-47-9
tert-butyl 5-hydroxyisoindoline-2-carboxylate

Guidance literature:: 5-hydroxy-isoindoline hydrobromide; With sodium hydrogencarbonate; In water; at 3 ℃; for 0.25h;

di-tert-butyl dicarbonate; In tetrahydrofuran; water; at 3 - 20 ℃; for 4h;