1-Methyl-1H-indazole-5-boronic Acid - CAS 590418-08-9
Catalog: |
BB030253 |
Product Name: |
1-Methyl-1H-indazole-5-boronic Acid |
CAS: |
590418-08-9 |
Synonyms: |
(1-methyl-5-indazolyl)boronic acid; (1-methylindazol-5-yl)boronic acid |
IUPAC Name: | (1-methylindazol-5-yl)boronic acid |
Description: | 1-Methyl-1H-indazole-5-boronic Acid (CAS# 590418-08-9) is a useful research chemical. |
Molecular Weight: | 175.98 |
Molecular Formula: | C8H9N2O2B |
Canonical SMILES: | B(C1=CC2=C(C=C1)N(N=C2)C)(O)O |
InChI: | InChI=1S/C8H9BN2O2/c1-11-8-3-2-7(9(12)13)4-6(8)5-10-11/h2-5,12-13H,1H3 |
InChI Key: | FPZFXDGMBDJLHR-UHFFFAOYSA-N |
Boiling Point: | 397.472 °C at 760 mmHg |
Density: | 1.271 g/cm3 |
MDL: | MFCD09870052 |
LogP: | -0.74690 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021152149-A1 | Ras inhibitors and methods of using the same | 20200131 |
WO-2021120890-A1 | Pyrazolyl derivatives useful as anti-cancer agents | 20191220 |
WO-2021124222-A1 | Pyrazolyl derivatives useful as anti-cancer agents | 20191220 |
WO-2021088787-A1 | Quinazoline compound used as axl inhibitor | 20191107 |
CN-110563732-A | 7- (trimethoxyphenyl) -pyrrolo [2,3-d ] pyrimidine and application thereof | 20190904 |
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: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.0757077 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 58.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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