5-Methyl-1H-indazole-4-boronic Acid - CAS 1245816-10-7
Catalog: |
BB005915 |
Product Name: |
5-Methyl-1H-indazole-4-boronic Acid |
CAS: |
1245816-10-7 |
Synonyms: |
(5-methyl-1H-indazol-4-yl)boronic acid; (5-methyl-1H-indazol-4-yl)boronic acid |
IUPAC Name: | (5-methyl-1H-indazol-4-yl)boronic acid |
Description: | 5-Methyl-1H-indazole-4-boronic Acid (CAS# 1245816-10-7) is a useful research chemical. |
Molecular Weight: | 175.98 |
Molecular Formula: | C8H9N2O2B |
Canonical SMILES: | B(C1=C(C=CC2=C1C=NN2)C)(O)O |
InChI: | InChI=1S/C8H9BN2O2/c1-5-2-3-7-6(4-10-11-7)8(5)9(12)13/h2-4,12-13H,1H3,(H,10,11) |
InChI Key: | HRURFOBSNYPWDM-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 ℃ |
LogP: | -0.44890 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021207172-A1 | Compounds and methods for targeted degradation of kras | 20200406 |
WO-2021190467-A1 | Spiro ring-containing quinazoline compound | 20200325 |
US-2021269434-A1 | Tricyclic compounds as inhibitors of kras | 20200110 |
CN-113061132-A | Condensed ring lactam compound, preparation method and application | 20200101 |
CN-113045570-A | Spiro-containing quinazoline compounds | 20191227 |
Complexity: | 191 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.0757077 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.0757077 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 69.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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