2-Chloro-5-methoxy-3-nitropyridine - CAS 1003711-55-4
Catalog: |
BB000205 |
Product Name: |
2-Chloro-5-methoxy-3-nitropyridine |
CAS: |
1003711-55-4 |
Synonyms: |
2-chloro-5-methoxy-3-nitropyridine; 2-chloro-5-methoxy-3-nitropyridine |
IUPAC Name: | 2-chloro-5-methoxy-3-nitropyridine |
Description: | 2-Chloro-5-methoxy-3-nitropyridine (CAS# 1003711-55-4) is a useful research chemical. |
Molecular Weight: | 188.57 |
Molecular Formula: | C6H5ClN2O3 |
Canonical SMILES: | COC1=CN=C(C(=C1)[N+](=O)[O-])Cl |
InChI: | InChI=1S/C6H5ClN2O3/c1-12-4-2-5(9(10)11)6(7)8-3-4/h2-3H,1H3 |
InChI Key: | AUHIVEPPZZIGNI-UHFFFAOYSA-N |
Boiling Point: | 316.2 °C at 760 mmHg |
Density: | 1.445 g/cm3 |
Storage: | Inert atmosphere, Room Temperature |
LogP: | 2.17500 |
GHS Hazard Statement: | H302+H312+H332 (100%): 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 |
CN-110272381-A | The Oseltamivir analog of the segment containing pyridine and its application | 20190619 |
WO-2020054788-A1 | Imidazopyridinone compound | 20180913 |
TW-202024077-A | Imidazopyridinone compound | 20180913 |
CA-3106385-A1 | Imidazopyridinone compound | 20180913 |
CN-112689637-A | Imidazopyridinone compounds | 20180913 |
Complexity: | 173 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.9988697 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.9988697 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 67.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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