Basic information
- Standard SMILES
COc1ccc(Cl)cc1C1(O)CCN(C(=O)OC(C)(C)C)CC1- InChIKey
LNSBPFXEFUUGKQ-UHFFFAOYSA-N- Molecular formula
- C17H24ClNO4
- Average molar mass
- 341.8 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 4-(5-chloro-2-methoxyphenyl)-4-hydroxypiperidine-1-carboxylate
- IUPAC
- tert-butyl 4-(5-chloro-2-methoxyphenyl)-4-hydroxypiperidine-1-carboxylate
Names & synonyms
tert-butyl 4-(5-chloro-2-methoxyphenyl)-4-hydroxypiperidine-1-carboxylateSCHEMBL1095800LNSBPFXEFUUGKQ-UHFFFAOYSA-NDB-160323tert-Butyl4-(5-chloro-2-methoxyphenyl)-4-hydroxypiperidine-1-carboxylate4-(5-chloro-2-methoxy-phenyl)-4-hydroxy-piperidine-1-carboxylic acid tert-butyl ester888965-95-5
Database identifiers
- PubChem CID
- 58772480
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 415
Related reactions
9 records
Linked notes
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