Methyl 2-Methylpiperidine-2-carboxylate Hydrochloride - CAS 72540-77-3
Catalog: |
BB072890 |
Product Name: |
Methyl 2-Methylpiperidine-2-carboxylate Hydrochloride |
CAS: |
72540-77-3 |
Synonyms: |
methyl 2-methylpiperidine-2-carboxylate hydrochloride; methyl 2-methylpiperidine-2-carboxylate; hydrochloride; Methyl 2-methylpiperidine-2-carboxylate HCl; Methyl 2-methyl-2-piperidinecarboxylate hydrochloride |
IUPAC Name: | methyl 2-methylpiperidine-2-carboxylatehydrochloride |
Molecular Weight: | 193.67 |
Molecular Formula: | C8H15NO2·HCl |
Canonical SMILES: | CC1(CCCCN1)C(=O)OC.Cl |
InChI: | InChI=1S/C8H15NO2.ClH/c1-8(7(10)11-2)5-3-4-6-9-8/h9H,3-6H2,1-2H31H |
InChI Key: | FZEWZZLRRJQKKT-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P333+P313, P362+P364, and P501 |
Signal Word: | Warning |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.0869564 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.0869564 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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