Ethyl 1-Methyl-2-oxopiperidine-3-carboxylate - CAS 21576-27-2
Catalog: |
BB016975 |
Product Name: |
Ethyl 1-Methyl-2-oxopiperidine-3-carboxylate |
CAS: |
21576-27-2 |
Synonyms: |
1-methyl-2-oxo-3-piperidinecarboxylic acid ethyl ester; ethyl 1-methyl-2-oxopiperidine-3-carboxylate |
IUPAC Name: | ethyl 1-methyl-2-oxopiperidine-3-carboxylate |
Description: | Ethyl 1-Methyl-2-oxopiperidine-3-carboxylate (CAS# 21576-27-2) is a useful research chemical. |
Molecular Weight: | 185.22 |
Molecular Formula: | C9H15NO3 |
Canonical SMILES: | CCOC(=O)C1CCCN(C1=O)C |
InChI: | InChI=1S/C9H15NO3/c1-3-13-9(12)7-5-4-6-10(2)8(7)11/h7H,3-6H2,1-2H3 |
InChI Key: | RCFIDKPBGWQLTE-UHFFFAOYSA-N |
LogP: | 0.35580 |
Publication Number | Title | Priority Date |
EP-3480190-A1 | Methods for enantioselective allylic alkylation of esters, lactones, and lactams with unactivated allylic alcohols | 20171101 |
US-10358422-B2 | Methods for enantioselective allylic alkylation of esters, lactones, and lactams with unactivated allylic alcohols | 20171101 |
US-2019135754-A1 | Methods for enantioselective allylic alkylation of esters, lactones, and lactams with unactivated allylic alcohols | 20171101 |
US-2020048201-A1 | Methods for enantioselective allylic alkylation of esters, lactones, and lactams with unactivated allylic alcohols | 20171101 |
US-10745354-B2 | Methods for enantioselective allylic alkylation of esters, lactones, and lactams with unactivated allylic alcohols | 20171101 |
Complexity: | 215 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.10519334 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.10519334 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.6 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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