1-Methylnipecotinic acid methyl ester
Properties
- Molecular formula
- C8H15NO2
- Molar mass
- 157.21 g/mol
- Exact mass
- 157.1103 Da
- Boiling point
- 93–94 °C (at 16 Torr)
- pKa
- 8.39
- logP
- 0.50Crippen estimate
- Polar surface area
- 29.5 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 1
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
1690-72-8SMILES
COC(=O)C1CCCN(C)C1InChIKey
LLEOWWWENNCINW-UHFFFAOYSA-NInChI
InChI=1S/C8H15NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h7H,3-6H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- 3-Piperidinecarboxylic acid, 1-methyl-, methyl ester
- Nipecotic acid, 1-methyl-, methyl ester
- Dihydroarecaidine, methyl ester
- Dihydroarecoline
- Methyl N-methylnipecotate
- Methyl 1-methylpiperidine-3-carboxylate
Work with 1-Methylnipecotinic acid methyl ester
Similar compounds
Ethyl 1-methyl-3-piperidinecarboxylate5166-67-667 % similar
Methyl cyclopentanecarboxylate4630-80-258 % similar
Cyclobutanecarboxylic acid methyl ester765-85-558 % similar
Methyl cyclohexanecarboxylate4630-82-456 % similar
1-Methylpiperidine-3-carboxylic acid5657-70-556 % similar
Methyl N-boc-piperidine-3-carboxylate148763-41-155 % similar
Methyl cyclopropanecarboxylate2868-37-352 % similar
1,4-Dimethyl trans-1,4-cyclohexanedicarboxylate3399-22-252 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.