Basic information
- Standard SMILES
O=C1CCN(c2ccc(C(=O)O)cc2)CC1- InChIKey
NFWVNUAXCFDVFD-UHFFFAOYSA-N- Molecular formula
- C12H13NO3
- Average molar mass
- 219.24 g/mol
Names & identifiers
- Preferred name
- 4-(4-Oxopiperidin-1-yl)benzoic acid
- IUPAC
- 4-(4-oxopiperidin-1-yl)benzoic acid
Names & synonyms
4-(4-Oxopiperidin-1-yl)benzoic acid197446-34-7MFCD097589944-(4-Oxo-piperidin-1-yl)-benzoic acid4-(4-oxo-1-piperidinyl)Benzoic acid4-(4-piperidon-1-yl)benzoic acidSCHEMBL1664948NFWVNUAXCFDVFD-UHFFFAOYSA-NXHA446344-(4-oxo-1-piperidyl)benzoic acid4-(4-Oxopiperidin-1-yl)benzoicacidAKOS015996350
Show more names
4-(4-Oxo-piperidin-1-y)-benzoic acid4-(4-Oxo-piperidine-1-y)-benzoic acidAS-53664DB-348694CS-0336601P16843F515626
Database identifiers
- PubChem CID
- 22064022
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 272
Related reactions
35 records
Compound notes
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