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SKU | Size | Availability | Price | Qty |
---|---|---|---|---|
T177730-1g | 1g | 3 | $114.90 | |
T177730-5g | 5g | 3 | $513.90 | |
T177730-10g | 10g | 3 | $923.90 |
Synonyms | 1-BOC-1H-INDALZOLE-5-BORONIC ACID PINACOL ESTER | AKOS022172514 | DTXSID70152424 | SCHEMBL760664 | 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole-1-carboxylic acid tert-butyl ester | AM85286 | tert-butyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan- |
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Specifications & Purity | ≥97% |
Shipped In | Normal |
Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Pubchem Sid | 504768727 |
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Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504768727 |
IUPAC Name | tert-butyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole-1-carboxylate |
INCHI | InChI=1S/C18H25BN2O4/c1-16(2,3)23-15(22)21-14-9-8-13(10-12(14)11-20-21)19-24-17(4,5)18(6,7)25-19/h8-11H,1-7H3 |
InChi Key | MMXDKXUKSKMROG-UHFFFAOYSA-N |
Canonical SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N(N=C3)C(=O)OC(C)(C)C |
Isomeric SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N(N=C3)C(=O)OC(C)(C)C |
PubChem CID | 18525862 |
Molecular Weight | 344.22 |
Melt Point(°C) | 115 °C |
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Molecular Weight | 344.200 g/mol |
XLogP3 | |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 3 |
Exact Mass | 344.191 Da |
Monoisotopic Mass | 344.191 Da |
Topological Polar Surface Area | 62.600 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 516.000 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
The total count of all stereochemical bonds | 0 |
Covalently-Bonded Unit Count | 1 |
Pictogram(s) | GHS07 |
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Signal | Warning |
Hazard Statements | H302:Harmful if swallowed |
Precautionary Statements | P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. |