3-Hydroxypiperidine
Completing data — refresh the page later to see the latest
Basic information
- CAS
6859-99-0- Standard SMILES
OC1CCCNC1- InChIKey
BIWOSRSKDCZIFM-UHFFFAOYSA-N- Molecular formula
- C5H11NO
- Average molar mass
- 101.15 g/mol
- Monoisotopic mass
- 101.08406397
Names & identifiers
- Preferred name
- 3-Hydroxypiperidine
- IUPAC
- piperidin-3-ol
- English name
- 3-Hydroxypiperidine
- Molecular formula
- C5H11NO
- Molecular weight
- 101.15
Names & synonyms
3-HydroxypiperidinePiperidin-3-ol6859-99-03-HydroxyhexahydropyridineEINECS 229-957-4NSC 62082RefChem:94384229-957-4BIWOSRSKDCZIFM-UHFFFAOYSA-N3-PIPERIDINOL3-hydroxy piperidineMFCD00014591
Show more names
Benidipine Impurity 173-hydroxyperidineOEM 3-Hydroxypiperidin3-Hydroxypiperidine>3-HYDROXYPIPERIDINE 98%(3R)-3-piperidin-1-iumol
Benidipine Impurity 4(+/-)-3-HYDROXYPIPERIDINENSC-620823-Hydroxypiperadinepiperidine-3-ol(+/-)-3-Piperidinol; (R,S)-3-Hydroxypiperidine; (+/-)-3-Hydroxypiperidine; 3-Hydroxyhexahydropyridine; NSC 62082NSC620823-hydroxy-piperdine
Database identifiers
- CAS
6859-99-0- PubChem CID
- 23293
- DTXSID
DTXSID70870212- ChEMBL
CHEMBL22463- UNII
- UH54C3N4VL
- EC Number
- 229-957-4
- Nikkaji
- J100.751C
Properties
Computed structural propertiesFilling in
- XLogP
- -0.3
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 56
Experimental & physicochemical properties
Collision Cross Section123.27 Ų [M+Na]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Physicochemical properties
- Melting point
- 57 · 57-61 °C
- Boiling point
- 67 · 67-69 °C (2 mmHg)
- Density
- 1.016 · 1.016±0.06 g/cm3(Predicted)
- Flash point
- 100 °C · >100°C
- storage temp.
- 2 · 2-8°C
- solubility
- 0.1 g/mL, · ethanol: 0.1 g/mL, clear
- pka
- 14.91 · 14.91±0.20(Predicted)
- form
- Crystalline Powder and Lumps
- color
- White to light yellow
- PH
- 11.5 · 11.5-11.7 (H2O)Aqueous solution
- Water Solubility
- soluble
- Sensitive
- Air Sensitive & Hygroscopic
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
Danger
H314 (92.2%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 7 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Status: Active Update: 30-08-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/20374
3-Piperidinol: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Corr. 1B (92.2%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 3
- ridadr
- UN 3263 8/PG 2
- hs_code
- 29333990
- risk_code
- 34-20/21/22-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C,Xi
- safety_code
- 26-36/37/39-45-27
- hazard_class
- 8
- Storage Class
- 11 - Combustible Solids
- packing_group
- III
Chemistry & industry
Applications
Uses3-Hydroxypiperidine is usually used for Synthesis of unsymmetrical ureas,Synthesis of piperidine nucleoside analogs,Fluorination reactions,Synthesis of substituted pyridines.
General Description3-Hydroxypiperidine can be obtained from the reduction of 3-hydroxypyridine.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
208 records
Compound notes
Loading…