CAS 3970-68-1 4-Methylpiperidin-4-ol (HCID 15649174)

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Grundinformationen

CAS: 3970-68-1
Standard-SMILES: CC1(O)CCNCC1
InChIKey: CXBLQEIODBBSQD-UHFFFAOYSA-N
Summenformel: C6H13NO
Durchschnittliche Molmasse: 115,17 g/mol
Monoisotopische Masse: 115,09971404

Namen und Bezeichner

Bevorzugter Name: 4-Methylpiperidin-4-ol
IUPAC: 4-methylpiperidin-4-ol
Englischer Name: 4-METHYLPIPERIDIN-4-OL
Summenformel: C6H13NO
Molmasse: 115.17

Namen und Synonyme

4-METHYLPIPERIDIN-4-OL3970-68-1DTXSID30576304RefChem:294667DTXCID50527075813-671-74-HYDROXY-4-METHYLPIPERIDINE4-Methyl-piperidin-4-olMFCD111009934-methyl-4-piperidinol4-PIPERIDINOL, 4-METHYL-4-methylpiperid-4-ol

Weitere Namen anzeigen

4-pipecolin-4-ol4-METHYLPIPERIDIN-4-OL hcl4-Hydroxy-4-methylpiperid...4-Methylpiperidin-4-ol4-methylpiperidin-4-ol

Hydroxy-4-methylpiperidineSCHEMBL868574-methyl-4-hydroxypiperidineSCHEMBL7397574-hydroxy-4 methyl-piperidine4-hydroxy-4-methyl-piperidineSCHEMBL4523643SCHEMBL19128040

Datenbank-Bezeichner

CAS: 3970-68-1
PubChem CID: 15649174
DTXSID: DTXSID30576304
EC Number: 813-671-7

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -0,1
Polarare Oberfläche (TPSA): 32,3 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 0
Schwere Atome: 8
Formalladung: 0
Komplexität: 76

Physikochemische Eigenschaften

Siedepunkt: 184.4 · 184.4±15.0 °C(Predicted)
Dichte: 0.976 · 0.976±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
pka: 15.01 · 15.01±0.20(Predicted)
Aggregatzustand: powder
Farbe: Light Yellow

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H314 (60%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (40%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (40%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P321, P332+P317, P337+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 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.