Grundinformationen
- Standard-SMILES
Cl.O=C(O)CN1CCCCC1- InChIKey
WKVJGLBBPPFCGD-UHFFFAOYSA-N- Summenformel
- C7H14ClNO2
- Durchschnittliche Molmasse
- 179,64 g/mol
- Monoisotopische Masse
- 179,07130637
Namen und Bezeichner
- Bevorzugter Name
- 2-(Piperidin-1-yl)acetic acid hydrochloride
- IUPAC
- 2-piperidin-1-ylacetic acid;hydrochloride
Namen und Synonyme
2-(piperidin-1-yl)acetic acid hydrochlorideRefChem:461849817-498-83235-68-5Piperidin-1-yl-acetic acid hydrochloride1-Piperidineacetic acid, hydrochloridePiperidinoacetic acid hydrochloride(Piperidin-1-yl)acetic acid hydrochlorideMFCD01701566Piperidin-1-ylacetic acid hydrochloride2-piperidin-1-ylacetic acid;hydrochlorideN-Carboxymethylpiperidine hydrochloride
Weitere Namen anzeigen
2-(1-piperidyl)acetic acid;hydrochlorideMLS000715451SCHEMBL863867CHEMBL1546923DTXSID60186071WKVJGLBBPPFCGD-UHFFFAOYSA-NDAA235681-piperidineacetic acid hydrochloride
Datenbank-Bezeichner
- CAS
3235-68-5- PubChem CID
- 201096
- DTXSID
DTXSID60186071- ChEMBL
CHEMBL1546923- EC Number
- 817-498-8
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 40,5 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 119
Experimentelle und physikochemische Eigenschaften
Solubility23.8 [ug/mL] (The mean of the results at pH 7.4)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Zugehörige Reaktionen
5
Verknüpfte Notizen
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