6-Hydroxy-2-methylnicotinonitrile - CAS 41877-40-1
Catalog: |
BB024984 |
Product Name: |
6-Hydroxy-2-methylnicotinonitrile |
CAS: |
41877-40-1 |
Synonyms: |
2-methyl-6-oxo-1H-pyridine-3-carbonitrile; 2-methyl-6-oxo-1H-pyridine-3-carbonitrile |
IUPAC Name: | 2-methyl-6-oxo-1H-pyridine-3-carbonitrile |
Description: | 6-Hydroxy-2-methylnicotinonitrile (CAS# 41877-40-1) is a useful research chemical. |
Molecular Weight: | 134.14 |
Molecular Formula: | C7H6N2O |
Canonical SMILES: | CC1=C(C=CC(=O)N1)C#N |
InChI: | InChI=1S/C7H6N2O/c1-5-6(4-8)2-3-7(10)9-5/h2-3H,1H3,(H,9,10) |
InChI Key: | BZFYYPFFELGRLN-UHFFFAOYSA-N |
Boiling Point: | 324.3 ℃ at 760 mmHg |
Density: | 1.2 g/cm3 |
MDL: | MFCD09909816 |
LogP: | 0.96728 |
Publication Number | Title | Priority Date |
US-2020165248-A1 | Imidazopyridine derivatives | 20181030 |
WO-2020092394-A1 | Imidazopyridine derivatives as alpha4beta7 integrin inhibitors | 20181030 |
TW-202030190-A | Imidazopyridine derivatives | 20181030 |
TW-I717080-B | Imidazopyridine derivatives | 20181030 |
CN-112969700-A | Imidazopyridine derivatives as alpha 4 beta 7 integrin inhibitors | 20181030 |
Complexity: | 277 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 134.048012819 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 134.048012819 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 52.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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