4-Methoxypyridine N-Oxide - CAS 1122-96-9
Catalog: |
BB002928 |
Product Name: |
4-Methoxypyridine N-Oxide |
CAS: |
1122-96-9 |
Synonyms: |
4-methoxy-1-oxidopyridin-1-ium; 4-methoxy-1-oxidopyridin-1-ium |
IUPAC Name: | 4-methoxy-1-oxidopyridin-1-ium |
Description: | 4-Methoxypyridine N-Oxide (CAS# 1122-96-9) is a useful research chemical. |
Molecular Weight: | 125.13 |
Molecular Formula: | C6H7NO2 |
Canonical SMILES: | COC1=CC=[N+](C=C1)[O-] |
InChI: | InChI=1S/C6H7NO2/c1-9-6-2-4-7(8)5-3-6/h2-5H,1H3 |
InChI Key: | BOFAIBPJCWFJFT-UHFFFAOYSA-N |
Boiling Point: | 308.9 °C at 760 mmHg |
Density: | 1.09 g/cm3 |
Appearance: | Ochre powder |
Storage: | Inert atmosphere, Room Temperature |
MDL: | MFCD00006207 |
LogP: | 1.12370 |
GHS Hazard Statement: | H302+H312+H332 (16.67%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021105105-A | Total aromatic polyesteramides, polyesteramide resin compositions, and articles | 20191226 |
JP-2021105107-A | Total aromatic polyesters, polyester resin compositions, and articles | 20191226 |
TW-202100161-A | 3'3'-cyclic dinucleotides and prodrugs thereof | 20190307 |
TW-202100163-A | 2'3'-cyclic dinucleotides and prodrugs thereof | 20190307 |
WO-2020178769-A1 | 2'3'-cyclic dinucleotides and prodrugs thereof | 20190307 |
Complexity: | 79.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 125.047678466 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 125.047678466 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 34.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.7 |
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Pyridines
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