2-(2-Methylpiperidin-1-yl)ethan-1-amine
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Basic information
- CAS
768-08-1- Standard SMILES
CC1CCCCN1CCN- InChIKey
DBSDZVMWEMKFCH-UHFFFAOYSA-N- Molecular formula
- C8H18N2
- Average molar mass
- 142.24 g/mol
- Monoisotopic mass
- 142.14699858
Names & identifiers
- Preferred name
- 2-(2-Methylpiperidin-1-yl)ethan-1-amine
- IUPAC
- 2-(2-methylpiperidin-1-yl)ethanamine
- English name
- 2-(2-methylpiperidin-1-yl)ethanamine
- Molecular formula
- C8H18N2
- Molecular weight
- 142.24
Names & synonyms
2-(2-methylpiperidin-1-yl)ethan-1-amineRefChem:454231837-521-52-(2-methylpiperidin-1-yl)ethanamine768-08-12-(2-Methyl-piperidin-1-yl)-ethylamine2-(2-methyl-1-piperidinyl)ethanamine2-(2-Methyl-1-piperidyl)ethanamineMFCD030303802-methyl-1-PiperidineethanamineALBB-0053622-(2-methylpiperidyl)ethylamine
Show more names
2-(2-methyl-1-piperidinyl)ethanamine(SALTDATA: FREE)
SCHEMBL3323166CHEMBL4518101SCHEMBL27680303DTXSID60389888DBSDZVMWEMKFCH-UHFFFAOYSA-N1-Piperidineethanamine, 2-methyl-STR07619SBB017916
Database identifiers
- CAS
768-08-1- PubChem CID
- 3149263
- DTXSID
DTXSID60389888- ChEMBL
CHEMBL4518101- EC Number
- 837-521-5
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 93.3
Physicochemical properties
- Boiling point
- 88 · 88-91 °C(Press: 18 Torr)
- Density
- 0.895 · 0.895±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 10.21 · 10.21±0.10(Predicted)
- Appearance
- Colorless to light yellow Liquid
- InChI
- InChI=1S/C8H18N2/c1-8-4-2-3-6-10(8)7-5-9/h8H,2-7,9H2,1H3
- InChIKey
- DBSDZVMWEMKFCH-UHFFFAOYSA-N
- SMILES
- N1(CCN)CCCCC1C
- Symbol(GHS)
- 7 · GHS07,GHS02
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H226
- Precautionary statements
- 501 · P501-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P403+P235
- HazardClass
- IRRITANT
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
H227 (100%): Combustible liquid [Warning Flammable liquids]
P210, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403, 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 CategoriesFlam. Liq. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS02
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H226
- Precautionary statements
- P501-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P403+P235
Suppliers
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Related reactions
3 records
Compound notes
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