4-Piperidinecarboxylic acid, 1-methyl-, hydrochloride (1:1)

HCID 2760043CAS 71235-92-2

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Grundinformationen

Standard-SMILES: CN1CCC(C(=O)O)CC1.Cl
InChIKey: NLUDEWJJEMHIIL-UHFFFAOYSA-N
Summenformel: C7H14ClNO2
Durchschnittliche Molmasse: 179,64 g/mol
Monoisotopische Masse: 179,07130637

Namen und Bezeichner

Bevorzugter Name: 4-Piperidinecarboxylic acid, 1-methyl-, hydrochloride (1:1)
IUPAC: 1-methylpiperidine-4-carboxylic acid;hydrochloride
Englischer Name: 1-Methylpiperidine-4-carboxylic acid hydrochloride
Summenformel: C7H14ClNO2
Molmasse: 179.64

Namen und Synonyme

71985-80-3RefChem:5265104-Piperidinecarboxylic acid, 1-methyl-, hydrochloride (1:1)1-methylpiperidine-4-carboxylic Acid Hydrochloride71235-92-21-methylpiperidine-4-carboxylic acid;hydrochlorideMFCD001902354-Piperidinecarboxylic acid, 1-methyl-, hydrochloride1-methylpiperidine-4-carboxylic acid hcl1-methyl-piperidine-4-carboxylic acid hydrochloride1-methyl-4-carboxypiperidine HCl1-METHYLPIPERIDINE-4-CARBOXYLICACIDHYDROCHLORIDE

Weitere Namen anzeigen

BIO-FARMA BF002150TIMTEC-BB SBB003751RARECHEM AH CK 01391-methylisonipecotic acid4-CARBOXY-1-METHYL-PIPERIDINE HCL1-methyl-4-piperidinecarboxylic acid1-methyl-4-piperidin-1-iumcarboxylate1-methylpiperidin-1-ium-4-carboxylate4-piperidinecarboxylic acid, 1-methyl-Methylpiperidincarbonsure hydrochloride

1-methyl-4-piperidinecarboxylic acid hydrochloride1-methylpiperidin-1-ium-4-carboxylic acid;chlorideF2167-00661-methyl-piperidine-4-carboxylic acid hydrochloride salt1-methylpiperidine-4-carboxylic acid hydrochloride salt1-methylpiperidine-4-carboxylic acid, chloride1-Methyl-piperidine-4-carboxylic Acid HydrochloridA866336

Datenbank-Bezeichner

CAS: 71235-92-2、71985-80-3
PubChem CID: 2760043
DTXSID: DTXSID40991544
EC Number: 671-493-3、815-057-4

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 40,5 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 1
Schwere Atome: 11
Formalladung: 0
Komplexität: 128

Physikochemische Eigenschaften

Schmelzpunkt: 234 · 234-235°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Warning

H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 4 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

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