4-Ethoxy-3-nitropyridine - CAS 1796-84-5
Catalog: |
BB013590 |
Product Name: |
4-Ethoxy-3-nitropyridine |
CAS: |
1796-84-5 |
Synonyms: |
4-ethoxy-3-nitropyridine; 4-ethoxy-3-nitropyridine |
IUPAC Name: | 4-ethoxy-3-nitropyridine |
Description: | 4-Ethoxy-3-nitropyridine (CAS# 1796-84-5) is a useful research chemical compound. |
Molecular Weight: | 168.15 |
Molecular Formula: | C7H8N2O3 |
Canonical SMILES: | CCOC1=C(C=NC=C1)[N+](=O)[O-] |
InChI: | InChI=1S/C7H8N2O3/c1-2-12-7-3-4-8-5-6(7)9(10)11/h3-5H,2H2,1H3 |
InChI Key: | ABOSMHRLVUWEMT-UHFFFAOYSA-N |
Boiling Point: | 287.5 °C at 760 mmHg |
Density: | 1.245 g/cm3 |
MDL: | MFCD00234959 |
LogP: | 1.91170 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3544980-A1 | Gsk-3 inhibitors | 20161128 |
JP-2019535790-A | GSK-3 inhibitor | 20161128 |
KR-20190085112-A | GSK-3 inhibitor | 20161128 |
US-2019276463-A1 | Gsk-3 inhibitors | 20161128 |
WO-2018098411-A1 | Gsk-3 inhibitors | 20161128 |
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 |
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