5-Methyl-2-(2-thienyl)-1,3-oxazole-4-carbaldehyde - CAS 915923-87-4
Catalog: |
BB040270 |
Product Name: |
5-Methyl-2-(2-thienyl)-1,3-oxazole-4-carbaldehyde |
CAS: |
915923-87-4 |
Synonyms: |
5-methyl-2-thiophen-2-yl-1,3-oxazole-4-carbaldehyde |
IUPAC Name: | 5-methyl-2-thiophen-2-yl-1,3-oxazole-4-carbaldehyde |
Description: | 5-Methyl-2-(2-thienyl)-1,3-oxazole-4-carbaldehyde (CAS# 915923-87-4) is a useful research chemical. |
Molecular Weight: | 193.22 |
Molecular Formula: | C9H7NO2S |
Canonical SMILES: | CC1=C(N=C(O1)C2=CC=CS2)C=O |
InChI: | InChI=1S/C9H7NO2S/c1-6-7(5-11)10-9(12-6)8-3-2-4-13-8/h2-5H,1H3 |
InChI Key: | ZFDVGEONFFIDAG-UHFFFAOYSA-N |
Boiling Point: | 355 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.304 g/cm3 |
MDL: | MFCD08059784 |
LogP: | 2.52400 |
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-2015191439-A1 | Inhibitors targeting drug-resistant influenza a | 20111206 |
US-9884832-B2 | Inhibitors targeting drug-resistant influenza A | 20111206 |
WO-2013086131-A1 | Inhibitors targeting drug-resistant influenza a | 20111206 |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.01974964 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.01974964 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 71.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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