4-[2-(Pyrrolidin-1-yl)ethyl]piperidine
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Basic information
- CAS
14759-08-1- Standard SMILES
C1CCN(CCC2CCNCC2)C1- InChIKey
LLCRHLSCWWMNEC-UHFFFAOYSA-N- Molecular formula
- C11H22N2
- Average molar mass
- 182.31 g/mol
- Monoisotopic mass
- 182.1782987
Names & identifiers
- Preferred name
- 4-[2-(Pyrrolidin-1-yl)ethyl]piperidine
- IUPAC
- 4-(2-pyrrolidin-1-ylethyl)piperidine
- English name
- 4-(2-PYRROLIDINOETHYL)PIPERIDINE
- Molecular formula
- C11H22N2
- Molecular weight
- 182.31
Names & synonyms
4-[2-(pyrrolidin-1-yl)ethyl]piperidine4-(2-(Pyrrolidin-1-yl)ethyl)piperidineDTXSID90304569RefChem:517260DTXCID10255701604-590-614759-08-14-(2-PYRROLIDINOETHYL)PIPERIDINE4-(2-pyrrolidin-1-ylethyl)piperidinePiperidine, 4-[2-(1-pyrrolidinyl)ethyl]-MFCD030929394-(2-Pyrrolidin-1-yl-ethyl)-piperidine
Show more names
1-[2-(Piperidin-4-yl)ethyl]pyrrolidine4-[2-(Pyrrolidin-1-yl)ethyl]piperidine98%4-[2-(Pyrrolidin-1-yl)ethyl]piperidine 98%
4-[2-(1-pyrrolidinyl)ethyl]piperidine4-(2-pyrrolidinylethyl)piperidineNSC166304SCHEMBL640737SCHEMBL2172470LLCRHLSCWWMNEC-UHFFFAOYSA-NALBB-021375SBB073146
Database identifiers
- CAS
14759-08-1- PubChem CID
- 296293
- DTXSID
DTXSID90304569- EC Number
- 604-590-6
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 135
Physicochemical properties
- Boiling point
- 253 ℃ · 253℃
- Density
- 0.93 · 0.930
- Flash point
- 90 ℃ · 90℃
- storage temp.
- 2 · 2-8°C
- pka
- 10.63 · 10.63±0.10(Predicted)
- form
- solid
- color
- Yellow to beige
- InChI
- 1S/C11H22N2/c1-2-9-13(8-1)10-5-11-3-6-12-7-4-11/h11-12H,1-10H2
- InChIKey
- LLCRHLSCWWMNEC-UHFFFAOYSA-N
- SMILES
- C1CCN(C1)CCC2CCNCC2
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 5 · GHS05,GHS06,GHS08
- Signal word
- Danger
- Hazard statements
- 330 · H330-H311-H302-H315-H318-H371-H317
- Precautionary statements
- 501 · P501-P272-P260-P270-P271-P264-P280-P284-P308+P311-P361+P364-P333+P313-P301+P312+P330-P302+P352+P312-P304+P340+P310-P305+P351+P338+P310-P403+P233-P405
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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
- wgk
- WGK 3
- hs_code
- 2933399990
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06,GHS08
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H330-H311-H302-H315-H318-H371-H317
- Precautionary statements
- P501-P272-P260-P270-P271-P264-P280-P284-P308+P311-P361+P364-P333+P313-P301+P312+P330-P302+P352+P312-P304+P340+P310-P305+P351+P338+P310-P403+P233-P405
Related reactions
15 records
Compound notes
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