| CAS Number | 1551413-97-8 |
| Catalog Number | AG00HYB3 |
| Chemical Name | (3-Cyclopropyl-1-methylindazol-5-yl)boronic acid |
| IUPAC Name | (3-cyclopropyl-1-methylindazol-5-yl)boronic acid |
| InChI | InChI=1S/C11H13BN2O2/c1-14-10-5-4-8(12(15)16)6-9(10)11(13-14)7-2-3-7/h4-7,15-16H,2-3H2,1H3 |
| InChI Key | RVDGTXWBYCSPTG-UHFFFAOYSA-N |
| MDL Number | MFCD27935709 |
| Molecular Formula | C11H13BN2O2 |
| Molecular Weight | 216.0441 |
| SMILES | CN1N=C(C2CC2)C3=C1C=CC(B(O)O)=C3 |
| Synonyms | (3-Cyclopropyl-1-methylindazol-5-yl)boronic acid,
1551413-97-8,
(3-cyclopropyl-1-methyl-1H-indazol-5-yl)boronic acid,
ZINC170001688,
CS-0056137,
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| Complexity | 273 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.107g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.047g/mol |
| Monoisotopic Mass | 216.107g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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