CAS 4045-25-4 4-Methoxypiperidine hydrochloride (HCID 11542813)

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Grundinformationen

CAS: 4045-25-4
Standard-SMILES: COC1CCNCC1.Cl
InChIKey: DMFJRRMECZFOKR-UHFFFAOYSA-N
Summenformel: C6H14ClNO
Durchschnittliche Molmasse: 151,63 g/mol
Monoisotopische Masse: 151,0763918

Namen und Bezeichner

Bevorzugter Name: 4-Methoxypiperidine hydrochloride
IUPAC: 4-methoxypiperidine;hydrochloride
Englischer Name: 4-Methoxypiperidine hydrochloride
Summenformel: C6H14ClNO
Molmasse: 151.63

Namen und Synonyme

4-methoxypiperidine Hydrochloride4045-25-4DTXSID70468274RefChem:524822DTXCID60419093640-837-44-Methoxy-piperidine HYDROCHLORIDEMFCD068009594-Methoxypiperidinehydrochloride4-methoxypiperidine;hydrochloridePIPERIDINE, 4-METHOXY-, HYDROCHLORIDE4-METHOXYPIPERIDINE HCL

Weitere Namen anzeigen

EOS-621834-Methoxypiperidine hydr...4-methoxy-1l2-piperidinehydrochloride4-Methoxypiperidine hydrochloride (1:1)Piperidine, 4-methoxy-, hydrochloride (1:1)

4-Methoxypiperidine, HClSCHEMBL714904-methoxypiperidine, chlorideDMFJRRMECZFOKR-UHFFFAOYSA-NEAA045254-methoxypiperidine monohydrochloride4-(methyloxy)piperidine hydrochlorideSBB086804

Datenbank-Bezeichner

CAS: 4045-25-4
PubChem CID: 11542813
DTXSID: DTXSID70468274
EC Number: 640-837-4

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 21,3 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 9
Formalladung: 0
Komplexität: 59

Physikochemische Eigenschaften

Schmelzpunkt: 137.5 · 137.5-139.5 °C
storage temp.: Sealed in dry,Room Temperature
Aggregatzustand: solid
Farbe: White
InChI: InChI=1S/C6H13NO.ClH/c1-8-6-2-4-7-5-3-6;/h6-7H,2-5H2,1H3;1H
InChIKey: DMFJRRMECZFOKR-UHFFFAOYSA-N
SMILES: N1CCC(OC)CC1.[H]Cl

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.