Ethyl 4-(Chlorocarbonyl)-1-piperidinecarboxylate - CAS 146801-00-5
Catalog: |
BB065790 |
Product Name: |
Ethyl 4-(Chlorocarbonyl)-1-piperidinecarboxylate |
CAS: |
146801-00-5 |
Synonyms: |
ethyl 4-(chlorocarbonyl)-1-piperidinecarboxylate; Ethyl 4-carbonochloridoylpiperidine-1-carboxylate; 4-Chlorocarbonyl-1-ethoxycarbonylpiperidine; ethyl 4-(carboxy)piperidine-1-carboxylate; 4-chlorocarbonyl-1-ethoxycarbonyl-piperidine; ethyl 4-chlorocarbonyl-1-piperidinecarboxylate |
IUPAC Name: | ethyl 4-carbonochloridoylpiperidine-1-carboxylate |
Molecular Weight: | 219.67 |
Molecular Formula: | C9H14ClNO3 |
Canonical SMILES: | CCOC(=O)N1CCC(CC1)C(=O)Cl |
InChI: | InChI=1S/C9H14ClNO3/c1-2-14-9(13)11-5-3-7(4-6-11)8(10)12/h7H,2-6H2,1H3 |
InChI Key: | QRMMXPXRMDHPPF-UHFFFAOYSA-N |
Complexity: | 224 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.066221 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.066221 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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