5-Methoxypyridine-2-carboxylic Acid - CAS 29082-92-6
Catalog: |
BB020086 |
Product Name: |
5-Methoxypyridine-2-carboxylic Acid |
CAS: |
29082-92-6 |
Synonyms: |
5-methoxy-2-pyridinecarboxylic acid; 5-methoxypyridine-2-carboxylic acid |
IUPAC Name: | 5-methoxypyridine-2-carboxylic acid |
Description: | A natural imino acid. |
Molecular Weight: | 153.14 |
Molecular Formula: | C7H7NO3 |
Canonical SMILES: | COC1=CN=C(C=C1)C(=O)O |
InChI: | InChI=1S/C7H7NO3/c1-11-5-2-3-6(7(9)10)8-4-5/h2-4H,1H3,(H,9,10) |
InChI Key: | YPKUGKJFOOZLHN-UHFFFAOYSA-N |
Boiling Point: | 312.9 °C at 760 mmHg |
Density: | 1.284 g/cm3 |
MDL: | MFCD06800961 |
LogP: | 0.78840 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112979672-A | 11, 20-dicarbonyl oridonin 14-O esterified series derivatives and application thereof | 20210305 |
KR-20200021494-A | Novel nucleoside or nucleotide derivatives, and use thereof | 20200220 |
KR-102145025-B1 | Novel nucleoside or nucleotide derivatives, and use thereof | 20200220 |
US-2021236663-A1 | Compounds and probes for imaging huntingtin protein | 20191218 |
WO-2021127265-A1 | Compounds and probes for imaging huntingtin protein | 20191218 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 153.042593085 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.042593085 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 59.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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Pyridines
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