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7295-76-3 | 3-Methoxypyridine
CAS No: 7295-76-3 Catalog No: AG0033QX MDL No:MFCD00673022
Product Description
Catalog Number:
AG0033QX
Chemical Name:
3-Methoxypyridine
CAS Number:
7295-76-3
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
MDL Number:
MFCD00673022
IUPAC Name:
3-methoxypyridine
InChI:
InChI=1S/C6H7NO/c1-8-6-3-2-4-7-5-6/h2-5H,1H3
InChI Key:
UMJSCPRVCHMLSP-UHFFFAOYSA-N
SMILES:
COc1cccnc1
EC Number:
230-730-7
UNII:
XV2A2D8595
Properties
Complexity:
65.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.053g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
109.128g/mol
Monoisotopic Mass:
109.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Synthesis, in vivo occupancy, and radiolabeling of potent phosphodiesterase subtype-10 inhibitors as candidates for positron emission tomography imaging. | Journal of medicinal chemistry 20110825 |
| Development and validation of a specific and sensitive GC-FID method for the determination of impurities in 5-chlorovaleroyl chloride. | Journal of pharmaceutical and biomedical analysis 20101102 |
| Lead optimization of 4-acetylamino-2-(3,5-dimethylpyrazol-1-yl)-6-pyridylpyrimidines as A2A adenosine receptor antagonists for the treatment of Parkinson's disease. | Journal of medicinal chemistry 20081127 |
| Pyridine-catalyzed stereoselective addition of acyclic 1,2-diones to acetylenic esters: synthetic and theoretical studies of an unprecedented rearrangement. | Chemistry (Weinheim an der Bergstrasse, Germany) 20080101 |
| Reactions of sulphate radicals with substituted pyridines: a structure-reactivity correlation analysis. | Chemphyschem : a European journal of chemical physics and physical chemistry 20071203 |
| Benzyl ether structure-activity relationships in a series of ketopiperazine-based renin inhibitors. | Bioorganic & medicinal chemistry letters 20051101 |
| Characterization of endoperoxide and hydroperoxide intermediates in the reaction of pyridoxine with singlet oxygen. | Journal of the American Chemical Society 20021016 |
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