2-Hydroxy-5-methyl-3-nitropyridine - CAS 7464-14-4
Catalog: |
BB035123 |
Product Name: |
2-Hydroxy-5-methyl-3-nitropyridine |
CAS: |
7464-14-4 |
Synonyms: |
5-methyl-3-nitro-1H-pyridin-2-one |
IUPAC Name: | 5-methyl-3-nitro-1H-pyridin-2-one |
Description: | 2-Hydroxy-5-methyl-3-nitropyridine (CAS# 7464-14-4) is a useful research chemical. |
Molecular Weight: | 154.12 |
Molecular Formula: | C6H6N2O3 |
Canonical SMILES: | CC1=CNC(=O)C(=C1)[N+](=O)[O-] |
InChI: | InChI=1S/C6H6N2O3/c1-4-2-5(8(10)11)6(9)7-3-4/h2-3H,1H3,(H,7,9) |
InChI Key: | QAINEQVHSHARMD-UHFFFAOYSA-N |
Boiling Point: | 353.3 °C at 760 mmHg |
Melting Point: | 179 °C |
Purity: | 98 % |
Density: | 1.36 g/cm3 |
Appearance: | White to yellow to brown powder, crystals or . |
MDL: | MFCD02070021 |
LogP: | 1.52700 |
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-2020033784-A1 | Transglutaminase 2 (tg2) inhibitors | 20180810 |
AU-2019318543-A1 | Transglutaminase 2 (TG2) inhibitors | 20180810 |
CN-112789040-A | Transglutaminase 2(TG2) inhibitors | 20180810 |
EP-3833348-A1 | Transglutaminase 2 (tg2) inhibitors | 20180810 |
KR-20210044248-A | Transglutaminase 2 (TG2) inhibitors | 20180810 |
PMID | Publication Date | Title | Journal |
22220136 | 20111101 | 2-Chloro-5-methyl-3-nitro-pyridine | Acta crystallographica. Section E, Structure reports online |
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: | 0.2 |
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Pyridines
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