Methyl(2-(piperidin-1-yl)ethyl)amine

HCID 3157473CAS 41239-39-8

Substructure search Find similar structures

Basic information

Standard SMILES: CNCCN1CCCCC1
InChIKey: KCAUHAHOMIRXAN-UHFFFAOYSA-N
Molecular formula: C8H18N2
Average molar mass: 142.24 g/mol
Monoisotopic mass: 142.14699858

Names & identifiers

Preferred name: Methyl(2-(piperidin-1-yl)ethyl)amine
IUPAC: N-methyl-2-piperidin-1-ylethanamine
English name: Methyl-(2-piperidin-1-yl-ethyl)-amine
Molecular formula: C8H18N2
Molecular weight: 142.24

Names & synonyms

methyl[2-(piperidin-1-yl)ethyl]amineMethyl(2-(piperidin-1-yl)ethyl)amineRefChem:818360852-712-341239-39-8N-methyl-2-piperidin-1-ylethanamineMethyl-(2-piperidin-1-yl-ethyl)-amineN-Methyl-2-(1-piperidyl)ethanamineMFCD07186367N-methyl-2-(1-piperidinyl)ethanamineN-methyl-2-(piperidin-1-yl)ethanamineN-methyl-2-(piperidin-1-yl)ethan-1-amine

Show more names

ALINDA 5443UKRORGSYN-BB BBV-153375ASINEX-REAG BAS 087671601-Piperidineethanamine, N-methyl-N-Methyl-1-piperidineethanamine 2HCl

SCHEMBL77007methyl(2-piperidylethyl)amineN-methyl-1-piperidineethanamineSCHEMBL1315646SCHEMBL2077311SCHEMBL6897917SCHEMBL28507019DTXSID00390130

Database identifiers

CAS: 41239-39-8
PubChem CID: 3157473
DTXSID: DTXSID00390130
EC Number: 852-712-3

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 15.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 10
Formal charge: 0
Complexity: 77.3

Physicochemical properties

Boiling point: 190 · 190-200 °C
Density: 0.886 · 0.886±0.06 g/cm3(Predicted)
storage temp.: Store at Room Tem.
pka: 10.48 · 10.48±0.10(Predicted)
Appearance: white solid
Symbol(GHS): 5 · GHS05,GHS07
Signal word: Danger
Hazard statements: 302 · H302-H335-H314
Precautionary statements: 260 · P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P403+P233-P405-P501
Hazard Codes: Xi
HazardClass: IRRITANT

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, 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

Signal word: Danger
Symbol(GHS): GHS05,GHS07
hazard_code: Xi
hazard_class: IRRITANT
Hazard statements: H302-H335-H314
Precautionary statements: P260-P264-P270-P271-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P403+P233-P405-P501