1-(6-Methoxypyridin-2-yl)piperazine

HCID 12200470

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Basic information

CAS: 51047-54-2
Standard SMILES: COc1cccc(N2CCNCC2)n1
InChIKey: OILYGSQXSLUZSY-UHFFFAOYSA-N
Molecular formula: C10H15N3O
Average molar mass: 193.25 g/mol
Monoisotopic mass: 193.1215121

Names & identifiers

Preferred name: 1-(6-Methoxypyridin-2-yl)piperazine
IUPAC: 1-(6-methoxy-2-pyridinyl)piperazine
English name: 1-(6-METHOXY-PYRIDIN-2-YL)-PIPERAZINE
Molecular formula: C10H15N3O
Molecular weight: 193.25

Names & synonyms

51047-54-21-(6-methoxypyridin-2-yl)piperazine1-(6-Methoxy-pyridin-2-yl)-piperazine1-(6-METHOXY-2-PYRIDYL)PIPERAZINE1-(6-methoxy-2-pyridinyl)piperazinePiperazine, 1-(6-methoxy-2-pyridinyl)-MFCD067388512-piperazino-6-methoxypyridineCHEMBL277929SCHEMBL2067367SCHEMBL2412819SCHEMBL3916764

Show more names

1-(6-METHOXY-2-PYRIDIL)PIPERAZINE

2-methoxy-6-piperazinylpyridine2-piperazino--6-methoxypyridineDTXSID90480155AKOS009463325AB28036ST081396CS-0303127H70752

Database identifiers

CAS: 51047-54-2
PubChem CID: 12200470
DTXSID: DTXSID90480155
ChEMBL: CHEMBL277929
EC Number: 676-436-6

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 37.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 171

Physicochemical properties

Boiling point: 348.8 · 348.8±37.0 °C(Predicted)
Density: 1.104 · 1.104±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
form: solid
pka: 8.53 · 8.53±0.10(Predicted)
InChI: 1S/C10H15N3O/c1-14-10-4-2-3-9(12-10)13-7-5-11-6-8-13/h2-4,11H,5-8H2,1H3
InChIKey: OILYGSQXSLUZSY-UHFFFAOYSA-N
UNSPSC Code: 12352005 · 12352005
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P332+P313-P337+P313-P362+P364
WGK Germany: 3 · WGK 3
Storage Class: 11 · 11 - Combustible Solids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.