4-Methoxy-1-methylpiperidine-4-carboxylic acid
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Basic information
- CAS
1082040-35-4- Standard SMILES
COC1(C(=O)O)CCN(C)CC1- InChIKey
REVIRQHWYXIURT-UHFFFAOYSA-N- Molecular formula
- C8H15NO3
- Average molar mass
- 173.21 g/mol
- Monoisotopic mass
- 173.10519334
Names & identifiers
- Preferred name
- 4-Methoxy-1-methylpiperidine-4-carboxylic acid
- IUPAC
- 4-methoxy-1-methylpiperidine-4-carboxylic acid
- English name
- 1-Methyl-4-methoxy-piperidine-4-Carbocylic acid
- Molecular formula
- C8H15NO3
- Molecular weight
- 173.21
Names & synonyms
1082040-35-44-methoxy-1-methylpiperidine-4-carboxylic acid1-Methyl-4-methoxy-piperidine-4-carboxylic acidMFCD11845434SCHEMBL243283764-Methoxy-1-methyl-4-piperidinecarboxylic acidAS-84040CS-0288349EN300-701709FT-0757358DTXSID001250024AKOS017515904
Show more names
1-Methyl-4-methoxy-piperidine-4-Carbocylic acid4-Piperidinecarboxylic acid, 4-methoxy-1-methyl-4-methoxy-1-methylpiperidine-4-carboxylic acid - [M81310]
SY32440SY324400DB-0597044-methoxy-1-methylpiperidine-4-carboxylicacidP211374-methoxy-1-methyl-piperidine-4-carboxylic acidF701773
Database identifiers
- CAS
1082040-35-4- PubChem CID
- 53399404
- DTXSID
DTXSID001250024
Properties
Computed structural propertiesFilling in
- XLogP
- -2.2
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 173
Physicochemical properties
- Boiling point
- 268.9 · 268.9±40.0 °C(Predicted)
- Density
- 1.15 · 1.15±0.1 g/cm3(Predicted)
- pka
- 2.72 · 2.72±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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