Basic information
- CAS
37656-66-9- Standard SMILES
CCOC(=O)N1CCC(Nc2ccc(Cl)cc2)CC1- InChIKey
MOVXNHXUSMSOGD-UHFFFAOYSA-N- Molecular formula
- C14H19ClN2O2
- Average molar mass
- 282.76 g/mol
- Monoisotopic mass
- 282.11350553
Names & identifiers
- Preferred name
- Ethyl 4-[(4-chlorophenyl)amino]piperidine-1-carboxylate
- IUPAC
- ethyl 4-(4-chloroanilino)piperidine-1-carboxylate
- English name
- ethyl 4-[(4-chlorophenyl)amino]piperidine-1-carboxylate
- Molecular formula
- C14H19ClN2O2
- Molecular weight
- 282.77
Names & synonyms
37656-66-9Ethyl 4-[(4-chlorophenyl)amino]piperidine-1-carboxylateethyl 4-(4-chloroanilino)piperidine-1-carboxylateD3GN362EFNEthyl 4-((4-chlorophenyl)amino)piperidine-1-carboxylateethyl 4-[(4-chlorophenyl)amino]-1-piperidinecarboxylateEINECS 253-578-3UNII-D3GN362EFNOprea1_020490SCHEMBL11457429DTXSID10191079DB-213674
Show more names
4-[(4-Chlorophenyl)amino]-1-piperidinecarboxylic acid ethyl ester
NS00030236SR-01000209759SR-01000209759-1ethyl 4-[(4-chlorophenyl)-amino]-1-piperidinecarboxylate1-Piperidinecarboxylic acid, 4-[(4-chlorophenyl)amino]-, ethyl ester
Database identifiers
- CAS
37656-66-9- PubChem CID
- 2846949
- DTXSID
DTXSID10191079- UNII
- D3GN362EFN
- EC Number
- 253-578-3
- Nikkaji
- J261.211I
Properties
Computed structural properties
- XLogP
- 3.4
- 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
- 285
Physicochemical properties
- Boiling point
- 427.6 · 427.6±35.0 °C(Predicted)
- Density
- 1.237 · 1.237±0.06 g/cm3(Predicted)
- pka
- 4.38 · 4.38±0.20(Predicted)
- FDA UNII
- 3 GN362EFN · D3GN362EFN
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers4 total
AKSCI[email protected]
WATERSTONE[email protected]
CHEMICAL LAND21[email protected]
3B Scientific Corporation[email protected]
Related reactions
27 records
Compound notes
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