4-Piperidinol, 1-benzyl-2,2,6,6-tetramethyl-, hydrocinnamate
Basic information
- CAS
20811-90-9- Standard SMILES
CC1(C)CC(OC(=O)CCc2ccccc2)CC(C)(C)N1Cc1ccccc1- InChIKey
HOGLVZDRLPOPQS-UHFFFAOYSA-N- Molecular formula
- C25H33NO2
- Average molar mass
- 379.5 g/mol
- Monoisotopic mass
- 379.2511293
Names & identifiers
- Preferred name
- 4-Piperidinol, 1-benzyl-2,2,6,6-tetramethyl-, hydrocinnamate
- IUPAC
- (1-benzyl-2,2,6,6-tetramethylpiperidin-4-yl) 3-phenylpropanoate
- English name
- 1-Benzyl-2,2,6,6-tetramethyl-4-piperidinol=3-phenylpropionate
- Molecular formula
- C25H33NO2
- Molecular weight
- 379.54
Names & synonyms
20811-90-94-Piperidinol, 1-benzyl-2,2,6,6-tetramethyl-, hydrocinnamateDTXSID90174926Hydrocinnamic acid, 1-benzyl-2,2,6,6-tetramethyl-4-piperidyl ester3-Phenylpropionic acid 1-benzyl-2,2,6,6-tetramethyl-4-piperidyl esterRefChem:295758DTXCID40974171-Benzyl-2,2,6,6-tetramethyl-4-piperidinol=3-phenylpropionate1-Benzyl-2,2,6,6-tetramethylpiperidin-4-yl 3-phenylpropanoateBenzenepropanoic acid, 2,2,6,6-tetramethyl-1-(phenylmethyl)-4-piperidinyl ester
Database identifiers
- CAS
20811-90-9- PubChem CID
- 64838
- DTXSID
DTXSID90174926- Nikkaji
- J50.694J
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 483
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Compound notes
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