| CAS Number | 952319-70-9 |
| Catalog Number | AG00IIVJ(AGN-PC-0WAN04) |
| Chemical Name | (1-Ethyl-1H-indazol-5-yl)boronic acid |
| IUPAC Name | (1-ethylindazol-5-yl)boronic acid |
| InChI | InChI=1S/C9H11BN2O2/c1-2-12-9-4-3-8(10(13)14)5-7(9)6-11-12/h3-6,13-14H,2H2,1H3 |
| InChI Key | MZNBKIHVFSCZLH-UHFFFAOYSA-N |
| MDL Number | MFCD22576144 |
| Molecular Formula | C9H11BN2O2 |
| Molecular Weight | 190.0068 |
| SMILES | CCN1N=CC2=C1C=CC(B(O)O)=C2 |
| Synonyms | (1-Ethyl-1H-indazol-5-yl)boronic acid,
952319-70-9,
1-ethyl-1H-indazol-5-ylboronic acid,
J-504588,
SCHEMBL4251433,
DTXSID00739444,
MZNBKIHVFSCZLH-UHFFFAOYSA-N,
MFCD22576144,
AKOS016014527,
ZINC169992750,
DS-6925,
FCH2305242,
RL06002,
AK131387,
AB0049926,
AX8252310,
4CH-005672,
CS-0054318,
Boronic acid, B-(1-ethyl-1H-indazol-5-yl)-,
(1-Ethyl-1H-indazol-5-yl)boronicacid,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.009g/mol |
| Monoisotopic Mass | 190.091g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number