2-Methylpyrimidine-5-boronic Acid - CAS 1034924-06-5
Catalog: |
BB001154 |
Product Name: |
2-Methylpyrimidine-5-boronic Acid |
CAS: |
1034924-06-5 |
Synonyms: |
(2-methyl-5-pyrimidinyl)boronic acid; (2-methylpyrimidin-5-yl)boronic acid |
IUPAC Name: | (2-methylpyrimidin-5-yl)boronic acid |
Description: | 2-Methylpyrimidine-5-boronic Acid (CAS# 1034924-06-5) is a useful research chemical. |
Molecular Weight: | 137.93 |
Molecular Formula: | C5H7N2O2B |
Canonical SMILES: | B(C1=CN=C(N=C1)C)(O)O |
InChI: | InChI=1S/C5H7BN2O2/c1-4-7-2-5(3-8-4)6(9)10/h2-3,9-10H,1H3 |
InChI Key: | BTJLWJOEZRVRNL-UHFFFAOYSA-N |
Appearance: | Solid |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD07375144 |
LogP: | -1.53520 |
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-2021202977-A1 | Pyrrolopyrimidine amines as complement inhibitors | 20200403 |
WO-2021173917-A1 | Inhibitors of receptor interacting protein kinase i for the treatment of disease | 20200228 |
WO-2021072198-A1 | Oral complement factor d inhibitors | 20191009 |
CN-112574191-A | Isoxazole heterocyclic compound and application thereof | 20190929 |
CN-112300126-A | Heterocyclic DNA-PK inhibitors | 20190731 |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 138.0600576 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 138.0600576 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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