4-[2-(Piperidin-4-yl)ethyl]phenol
Basic information
- CAS
501359-58-6- Standard SMILES
Oc1ccc(CCC2CCNCC2)cc1- InChIKey
XOEAPHOMOYPGTA-UHFFFAOYSA-N- Molecular formula
- C13H19NO
- Average molar mass
- 205.3 g/mol
- Monoisotopic mass
- 205.14666423
Names & identifiers
- Preferred name
- 4-[2-(Piperidin-4-yl)ethyl]phenol
- IUPAC
- 4-(2-piperidin-4-ylethyl)phenol
Names & synonyms
4-[2-(piperidin-4-yl)ethyl]phenol501359-58-64-(2-(piperidin-4-yl)ethyl)phenolRefChem:512092825-568-44-(2-piperidin-4-ylethyl)phenolMFCD08691145NSC12241SCHEMBL11997444-[2-(4-piperidyl)ethyl]phenolBVA35958NSC-12241
Show more names
AKOS009103713CS-0243113EN300-25930G57994Z220327458
Database identifiers
- CAS
501359-58-6- PubChem CID
- 224026
- EC Number
- 825-568-4
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 169
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (50%)
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Related reactions
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Compound notes
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