2-Hydroxy-4-methyl-5-nitropyridine - CAS 21901-41-7
Catalog: |
BB017198 |
Product Name: |
2-Hydroxy-4-methyl-5-nitropyridine |
CAS: |
21901-41-7 |
Synonyms: |
2(1H)-Pyridinone, 4-methyl-5-nitro-; 2-Pyridinol, 4-methyl-5-nitro-; 4-Methyl-5-nitro-2(1H)-pyridinone; 4-Methyl-5-nitropyridin-2(1H)-one; 4-Methyl-5-nitropyridin-2-ol; NSC 402987 |
IUPAC Name: | 4-methyl-5-nitro-1H-pyridin-2-one |
Molecular Weight: | 154.12 |
Molecular Formula: | C6H6N2O3 |
Canonical SMILES: | CC1=CC(=O)NC=C1[N+](=O)[O-] |
InChI: | InChI=1S/C6H6N2O3/c1-4-2-6(9)7-3-5(4)8(10)11/h2-3H,1H3,(H,7,9) |
InChI Key: | AIEHUZHKFUNHCJ-UHFFFAOYSA-N |
Boiling Point: | 323.7±35.0°C at 760 mmHg |
Melting Point: | 189-190°C |
Purity: | ≥95% |
Density: | 1.36±0.1 g/cm3 |
Solubility: | Soluble in Water |
Appearance: | Yellow to Orange Crystalline Powder |
Storage: | Store at RT |
MDL: | MFCD00010690 |
LogP: | 1.52700 |
GHS Hazard Statement: | H302 (11.11%): 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-2021209055-A1 | Imidazolinone derivative and use thereof in medicine | 20200417 |
US-2021078999-A1 | Plasma kallikrein inhibitors and uses thereof | 20190918 |
WO-2021055621-A1 | Plasma kallikrein inhibitors and uses thereof | 20190918 |
WO-2020018848-A1 | Methods of culturing and/or expanding stem cells and/or lineage committed progenitor cells using amido compounds | 20180719 |
CN-110357809-A | A kind of simple and convenient process for preparing of 4- methyl piperidine -3- ketone and its derivative | 20180410 |
Complexity: | 272 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.03784206 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.03784206 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 74.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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Pyridines
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