Ethyl 2-oxo-3-piperidinecarboxylate - CAS 3731-16-6
Catalog: |
BB023252 |
Product Name: |
Ethyl 2-oxo-3-piperidinecarboxylate |
CAS: |
3731-16-6 |
Synonyms: |
ethyl 2-oxopiperidine-3-carboxylate |
IUPAC Name: | ethyl 2-oxopiperidine-3-carboxylate |
Description: | Ethyl 2-oxo-3-piperidinecarboxylate (CAS# 3731-16-6) is a useful research chemical. |
Molecular Weight: | 171.19 |
Molecular Formula: | C8H13NO3 |
Canonical SMILES: | CCOC(=O)C1CCCNC1=O |
InChI: | InChI=1S/C8H13NO3/c1-2-12-8(11)6-4-3-5-9-7(6)10/h6H,2-5H2,1H3,(H,9,10) |
InChI Key: | DUMNOWYWTAYLJN-UHFFFAOYSA-N |
Boiling Point: | 326 °C at 760 mmHg |
Density: | 1.118 g/cm3 |
MDL: | MFCD00006038 |
LogP: | 0.40450 |
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 |
WO-2021116476-A1 | Agonists of rna adenosine n-6 methylation for use in suppressing hiv-1 latent provirus activation and replication | 20191212 |
WO-2021042058-A2 | Recombinant host cells for the production of malonate | 20190830 |
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CN-113166158-A | 7-, 8-and 10-substituted aminotriazoloquinazoline derivatives as adenosine receptor antagonists, pharmaceutical compositions and uses thereof | 20181130 |
US-2020079770-A1 | PYRAZOLO[3,4-b]PYRIDINE COMPOUNDS AS INHIBITORS OF TAM AND MET KINASES | 20180830 |
PMID | Publication Date | Title | Journal |
22136433 | 20120112 | 7,8-dichloro-1-oxo-β-carbolines as a versatile scaffold for the development of potent and selective kinase inhibitors with unusual binding modes | Journal of medicinal chemistry |
Complexity: | 191 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.08954328 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.08954328 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 55.4 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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