4-Methoxy-3-methylpyridine - CAS 96609-78-8
Catalog: |
BB041995 |
Product Name: |
4-Methoxy-3-methylpyridine |
CAS: |
96609-78-8 |
Synonyms: |
4-methoxy-3-methylpyridine; 4-methoxy-3-methylpyridine |
IUPAC Name: | 4-methoxy-3-methylpyridine |
Description: | 4-Methoxy-3-methylpyridine (CAS# 96609-78-8 ) is a useful research chemical. |
Molecular Weight: | 123.15 |
Molecular Formula: | C7H9NO |
Canonical SMILES: | CC1=C(C=CN=C1)OC |
InChI: | InChI=1S/C7H9NO/c1-6-5-8-4-3-7(6)9-2/h3-5H,1-2H3 |
InChI Key: | NCBHMODQBDKRJC-UHFFFAOYSA-N |
Boiling Point: | 188.8 °C at 760 mmHg |
Density: | 1.001 g/cm3 |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 1.39860 |
GHS Hazard Statement: | H302 (100%): 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-2021104256-A1 | Heterocyclic derivative, pharmaceutical composition thereof and use thereof | 20191125 |
WO-2021028935-A1 | Heterocyclic compounds, and their use as allosteric modulators of 5-hydroxytryptamine 2c receptor (5-ht2cr) | 20190812 |
WO-2020160180-A1 | Compounds and uses thereof | 20190129 |
WO-2020118066-A1 | Combination therapies | 20181205 |
WO-2020065614-A1 | Monoacylglycerol lipase modulators | 20180928 |
Complexity: | 85 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 123.068413911 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 123.068413911 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 22.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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