Ethyl 3-Aminoquinoline-2-carboxylate - CAS 62235-59-0
Catalog: |
BB031471 |
Product Name: |
Ethyl 3-Aminoquinoline-2-carboxylate |
CAS: |
62235-59-0 |
Synonyms: |
3-amino-2-quinolinecarboxylic acid ethyl ester; ethyl 3-aminoquinoline-2-carboxylate |
IUPAC Name: | ethyl 3-aminoquinoline-2-carboxylate |
Description: | Ethyl 3-Aminoquinoline-2-carboxylate (CAS# 62235-59-0) is a useful research chemical. |
Molecular Weight: | 216.24 |
Molecular Formula: | C12H12N2O2 |
Canonical SMILES: | CCOC(=O)C1=NC2=CC=CC=C2C=C1N |
InChI: | InChI=1S/C12H12N2O2/c1-2-16-12(15)11-9(13)7-8-5-3-4-6-10(8)14-11/h3-7H,2,13H2,1H3 |
InChI Key: | DXRZFETVSRVQEV-UHFFFAOYSA-N |
LogP: | 2.93350 |
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 |
WO-2020223685-A1 | Polymorphic compounds and uses thereof | 20190502 |
WO-2020223717-A1 | Process for preparation of aldehyde scavenger and intermediates | 20190502 |
EP-3440068-A1 | Pesticidally active heterocyclic derivatives with sulphur containing substituents | 20160407 |
EP-3440068-B1 | Pesticidally active heterocyclic derivatives with sulphur containing substituents | 20160407 |
JP-2019513739-A | Pesticidally active heterocyclic derivatives having sulfur-containing substituents | 20160407 |
Complexity: | 257 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 216.089877630 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 216.089877630 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 65.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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