142273-84-5 Purity
98%
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Specification
The molecular formula of 5-Indolylboronic acid is C8H8BNO2.
The molecular weight of 5-Indolylboronic acid is 160.97 g/mol.
The IUPAC name of 5-Indolylboronic acid is 1H-indol-5-ylboronic acid.
The InChI of 5-Indolylboronic acid is InChI=1S/C8H8BNO2/c11-9(12)7-1-2-8-6(5-7)3-4-10-8/h1-5,10-12H.
The InChIKey of 5-Indolylboronic acid is VHADYSUJZAPXOW-UHFFFAOYSA-N.
The canonical SMILES of 5-Indolylboronic acid is B(C1=CC2=C(C=C1)NC=C2)(O)O.
The CAS number of 5-Indolylboronic acid is 144104-59-6.
The European Community (EC) number of 5-Indolylboronic acid is 627-180-9.
The ChEMBL ID of 5-Indolylboronic acid is CHEMBL342460.
Yes, 5-Indolylboronic acid is a canonicalized compound.
Reference: [1] Tetrahedron Letters, 2017, vol. 58, # 1, p. 35 - 42
Reference: [1] Patent: WO2006/51851, 2006, A1, . Location in patent: Page/Page column 71-72
Reference: [1] Patent: US6307056, 2001, B1,
Reference: [1]Heterocycles,1992,vol. 34,p. 1395 - 1398
Reference: [1]Heterocycles,1992,vol. 34,p. 1395 - 1398
Reference: [1]Location in patent: scheme or table
Worm-Leonhard, Kasper; Meldal, Morten
[European Journal of Organic Chemistry, 2008, # 31, p. 5244 - 5253]
* For details of the synthesis route, please refer to the original source to ensure accuracy.