Ethyl 3-Aminopyridine-2-carboxylate - CAS 27507-15-9
Catalog: |
BB019595 |
Product Name: |
Ethyl 3-Aminopyridine-2-carboxylate |
CAS: |
27507-15-9 |
Synonyms: |
3-amino-2-pyridinecarboxylic acid ethyl ester; ethyl 3-aminopyridine-2-carboxylate |
IUPAC Name: | ethyl 3-aminopyridine-2-carboxylate |
Description: | A synthetic intermediate for the synthesis of Kenpaullone derivatives, Cannabinoid receptor ligands, and nociceptive agents. |
Molecular Weight: | 166.18 |
Molecular Formula: | C8H10N2O2 |
Canonical SMILES: | CCOC(=O)C1=C(C=CC=N1)N |
InChI: | InChI=1S/C8H10N2O2/c1-2-12-8(11)7-6(9)4-3-5-10-7/h3-5H,2,9H2,1H3 |
InChI Key: | FKDRDUIRSZRBSN-UHFFFAOYSA-N |
Boiling Point: | 326.2 °C at 760 mmHg |
Density: | 1.192 g/cm3 |
MDL: | MFCD00661294 |
LogP: | 1.42170 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20210081139-A | Compound, Organic EL Device and Display Device | 20191223 |
US-2021188845-A1 | Substituted bicyclic compounds useful as t cell activators | 20191223 |
WO-2021132952-A1 | Compound, organic electroluminescent element, and display device | 20191223 |
WO-2021133750-A1 | Substituted bicyclic piperidine derivatives useful as t cell activators | 20191223 |
WO-2021133752-A1 | Substituted heteroaryl compounds useful as t cell activators | 20191223 |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.074227566 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 65.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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