2-Ethoxy-5-nitropyridine - CAS 31594-45-3
Catalog: |
BB020988 |
Product Name: |
2-Ethoxy-5-nitropyridine |
CAS: |
31594-45-3 |
Synonyms: |
2-ethoxy-5-nitropyridine |
IUPAC Name: | 2-ethoxy-5-nitropyridine |
Description: | 2-Ethoxy-5-nitropyridine (CAS# 31594-45-3) is a useful research chemical. |
Molecular Weight: | 168.15 |
Molecular Formula: | C7H8N2O3 |
Canonical SMILES: | CCOC1=NC=C(C=C1)[N+](=O)[O-] |
InChI: | InChI=1S/C7H8N2O3/c1-2-12-7-4-3-6(5-8-7)9(10)11/h3-5H,2H2,1H3 |
InChI Key: | LYDVDLYMQVSLQD-UHFFFAOYSA-N |
Boiling Point: | 272.3 ℃ at 760 mmHg |
Melting Point: | 90-94 ℃ |
Purity: | 98 % |
Density: | 1.245 g/cm3 |
MDL: | MFCD01646181 |
LogP: | 1.91170 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2015266825-A1 | 5-substituted indazole-3-carboxamides and preparation and use thereof | 20140320 |
US-9745271-B2 | 5-substituted indazole-3-carboxamides and preparation and use thereof | 20140320 |
JP-2013155159-A | Polymeric platinum antitumor agent and method for producing the same | 20120131 |
US-2011275608-A1 | Piperidine-containing compounds and use thereof | 20090112 |
US-8809538-B2 | Piperidine-containing compounds and use thereof | 20090112 |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.05349212 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.05349212 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 67.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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