N-Carbethoxy-4-nortropinone - CAS 32499-64-2
Catalog: |
BB021312 |
Product Name: |
N-Carbethoxy-4-nortropinone |
CAS: |
32499-64-2 |
Synonyms: |
3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethyl ester; ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate |
IUPAC Name: | ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate |
Description: | N-Carbethoxy-4-nortropinone (CAS# 32499-64-2) is a useful research chemical. |
Molecular Weight: | 197.23 |
Molecular Formula: | C10H15NO3 |
Canonical SMILES: | CCOC(=O)N1C2CCC1CC(=O)C2 |
InChI: | InChI=1S/C10H15NO3/c1-2-14-10(13)11-7-3-4-8(11)6-9(12)5-7/h7-8H,2-6H2,1H3 |
InChI Key: | ANEJUHJDPGTVIO-UHFFFAOYSA-N |
Boiling Point: | 152-153 °C / 11 mmHg, 311.3 °C at 760 mmHg |
Density: | 1.198 g/cm3 |
Appearance: | Light yellow liquid |
MDL: | MFCD00078171 |
LogP: | 1.27670 |
Publication Number | Title | Priority Date |
WO-2020115505-A1 | Bicyclic aza compounds as muscarinic m1 and/or m4 receptor agonists | 20181207 |
EP-3891140-A1 | Bicyclic aza compounds as muscarinic m1 and/or m4 receptor agonists | 20181207 |
US-10501483-B2 | Enamines and diastereo-selective reduction of enamines | 20171024 |
US-2019119304-A1 | Enamines and diastereo-selective reduction of enamines | 20171024 |
WO-2019084070-A1 | ENAMINES AND DIASSEOSOLECTIVE REDUCTION OF ÉNAMINES | 20171024 |
Complexity: | 248 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.10519334 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.10519334 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.6 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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