3-(Piperidin-1-yl)phenol
Basic information
- CAS
27292-50-8- Standard SMILES
Oc1cccc(N2CCCCC2)c1- InChIKey
YNLRDTBLEOQPQL-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- 3-(Piperidin-1-yl)phenol
- IUPAC
- 3-piperidin-1-ylphenol
- English name
- 3-Piperidinophenol
- Molecular formula
- C11H15NO
- Molecular weight
- 177.24
Names & synonyms
3-(piperidin-1-yl)phenolDTXSID60282027RefChem:495868DTXCID70233181852-372-627292-50-83-piperidinophenol3-piperidin-1-ylphenolMFCD000530013-(1-Piperidyl)phenolNSC238943-hydroxyphenyl piperidine
Show more names
3-PiperidinohenolPhenol, 3-(1-piperidinyl)-
SCHEMBL1263793SCHEMBL5545870SCHEMBL9690664SCHEMBL22399242YNLRDTBLEOQPQL-UHFFFAOYSA-NNSC-23894AKOS006227814FS-3499
Database identifiers
- CAS
27292-50-8- PubChem CID
- 229855
- DTXSID
DTXSID60282027- EC Number
- 852-372-6
- Nikkaji
- J32.665H
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 154
Physicochemical properties
- Melting point
- 123 · 123-124 °C
- Boiling point
- 338.9 · 338.9±25.0 °C(Predicted)
- Density
- 1.106 · 1.106±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 10.37 · 10.37±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
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 (100%): 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers
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Related reactions
5 records
Compound notes
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