1-Ethylpiperidin-3-yl hydrogen (2-methylphenyl)carbonimidate
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Basic information
- CAS
33531-59-8- Standard SMILES
CCN1CCCC(OC(=O)Nc2ccccc2C)C1- InChIKey
UMCNJMVTYNYAGF-UHFFFAOYSA-N- Molecular formula
- C15H22N2O2
- Average molar mass
- 262.35 g/mol
- Monoisotopic mass
- 262.16812795
Names & identifiers
- Preferred name
- 1-Ethylpiperidin-3-yl hydrogen (2-methylphenyl)carbonimidate
- IUPAC
- (1-ethylpiperidin-3-yl) N-(2-methylphenyl)carbamate
- English name
- 2-Methylphenylcarbamic acid 1-ethyl-3-piperidyl ester
- Molecular formula
- C15H22N2O2
- Molecular weight
- 262.35
Names & synonyms
33531-59-8DTXSID609551631-Ethylpiperidin-3-yl hydrogen (2-methylphenyl)carbonimidateRefChem:1055462DTXCID9013831652-Methylphenylcarbamic acid 1-ethyl-3-piperidyl esterN-Ethyl-3-piperidyl 2-methylphenylcarbamateBRN 1538458o-Methylcarbanilic acid, N-ethyl-3-piperidinyl esterCARBANILIC ACID, o-METHYL-, N-ETHYL-3-PIPERIDINYL ESTERDB-2613452-Methylcarbanilic acid 1-ethyl-3-piperidyl ester
Show more names
Carbanilic acid, o-methyl-, 1-ethyl-3-piperidyl ester (8CI)
Database identifiers
- CAS
33531-59-8- PubChem CID
- 36545
- DTXSID
DTXSID60955163- Nikkaji
- J68.097D
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 296
Physicochemical properties
- Boiling point
- 405.6 °C · 405.6°C (rough estimate)
- Density
- 1.0396 · 1.0396 (rough estimate)
- refractive index
- 1.628 · 1.6280 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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