Methyl 2-(piperazin-1-yl)acetate dihydrochloride

HCID 53398818

Notizen Reaktionen

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

CAS: 179689-65-7
Standard-SMILES: COC(=O)CN1CCNCC1.Cl.Cl
InChIKey: CDYBIEKUAQBESG-UHFFFAOYSA-N
Summenformel: C7H16Cl2N2O2
Durchschnittliche Molmasse: 231,12 g/mol
Monoisotopische Masse: 230,0588831

Namen und Bezeichner

Bevorzugter Name: Methyl 2-(piperazin-1-yl)acetate dihydrochloride
IUPAC: methyl 2-piperazin-1-ylacetate;dihydrochloride
Englischer Name: methyl 1-piperazinylacetate dihydrochloride
Summenformel: C7H16Cl2N2O2
Molmasse: 231.12014

Namen und Synonyme

179689-65-7methyl 2-(piperazin-1-yl)acetate dihydrochlorideRefChem:813758864-471-1methyl 2-piperazin-1-ylacetate;dihydrochlorideMethyl 1-piperazinylacetate dihydrochlorideMFCD13857435Methyl piperazin-1-ylacetate dihydrochloridemethyl 1-piperazinylacetate1-piperazineacetic acid, methyl ester, dihydrochlorideMethyl 2-piperazin-1-ylacetate dihydrochlorideMETHYL 2-(PIPERAZIN-1-YL)ACETATE 2HCL

Weitere Namen anzeigen

SCHEMBL8483418dihydrochloride - [M83797]CDYBIEKUAQBESG-UHFFFAOYSA-NEHA68965AKOS015900435FS-5793Methyl 2-(piperazin-1-yl)acetate diHClSY259910

Datenbank-Bezeichner

CAS: 179689-65-7
PubChem CID: 53398818
EC Number: 864-471-1

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 41,6 Å²
H-Brücken-Donoren: 3
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 3
Schwere Atome: 13
Formalladung: 0
Komplexität: 132

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

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, 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 1 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.