Methyl 1,2,3,4-tetrahydroquinoline-6-carboxylate - CAS 177478-49-8
Catalog: |
BB013297 |
Product Name: |
Methyl 1,2,3,4-tetrahydroquinoline-6-carboxylate |
CAS: |
177478-49-8 |
Synonyms: |
methyl 1,2,3,4-tetrahydroquinoline-6-carboxylate |
IUPAC Name: | methyl 1,2,3,4-tetrahydroquinoline-6-carboxylate |
Description: | Methyl 1,2,3,4-tetrahydroquinoline-6-carboxylate (CAS# 177478-49-8) is a useful research chemical. |
Molecular Weight: | 191.23 |
Molecular Formula: | C11H13NO2 |
Canonical SMILES: | COC(=O)C1=CC2=C(C=C1)NCCC2 |
InChI: | InChI=1S/C11H13NO2/c1-14-11(13)9-4-5-10-8(7-9)3-2-6-12-10/h4-5,7,12H,2-3,6H2,1H3 |
InChI Key: | PPSPOJUGGLXCIV-UHFFFAOYSA-N |
Boiling Point: | 349.4 ℃ at 760 mmHg |
Density: | 1.123 g/cm3 |
MDL: | MFCD08692534 |
LogP: | 1.96930 |
GHS Hazard Statement: | H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113264876-A | Method for selectively catalyzing and hydrogenating aromatic heterocyclic compounds by non-hydrogen participation | 20210528 |
WO-2021127166-A1 | Inhibitors of enl/af9 yeats | 20191217 |
WO-2020185738-A1 | Heteroaromatic and heterobicyclic aromatic derivatives for the treatment of ferroptosis-related disorders | 20190311 |
CN-109529907-B | Nitrogen-doped carbon material supported cobalt catalyst, preparation method thereof and application thereof in catalytic oxidation of N-heterocyclic compound | 20181230 |
EP-3630770-A1 | Pyrazolo[3,4-b]pyrazine derivatives as shp2 phosphatase inhibitors | 20170526 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.094628657 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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