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SKU | Size | Availability | Price | Qty |
---|---|---|---|---|
M586651-250mg | 250mg | Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience! | $101.90 | |
M586651-1g | 1g | 2 | $364.90 |
Synonyms | 1217500-64-5 | D92871 | 5-(METHOXYCARBONYL)-1H-PYRROL-2-YLBORONIC ACID | (5-(Methoxycarbonyl)-1H-pyrrol-2-yl)boronic acid | BCP17117 | (5-methoxycarbonyl-1H-pyrrol-2-yl)boronic acid | 5-(METHOXYCARBONYL)PYRROLE-2-BORONIC ACID | DTXSID90681544 | (5-(Methox |
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Specifications & Purity | ≥98% |
Storage Temp | Store at -20°C,Argon charged |
Shipped In | Ice chest + Ice pads |
IUPAC Name | (5-methoxycarbonyl-1H-pyrrol-2-yl)boronic acid |
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INCHI | InChI=1S/C6H8BNO4/c1-12-6(9)4-2-3-5(8-4)7(10)11/h2-3,8,10-11H,1H3 |
InChi Key | OERJCWGVVLKNIL-UHFFFAOYSA-N |
Canonical SMILES | B(C1=CC=C(N1)C(=O)OC)(O)O |
Isomeric SMILES | B(C1=CC=C(N1)C(=O)OC)(O)O |
PubChem CID | 53216292 |
Molecular Weight | 168.94 |
Molecular Weight | 168.950 g/mol |
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XLogP3 | |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 169.055 Da |
Monoisotopic Mass | 169.055 Da |
Topological Polar Surface Area | 82.600 Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 175.000 |
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 |