1-(Cyclohexylmethyl)piperazine

HCID 2735885CAS 57184-23-3

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Grundinformationen

Standard-SMILES: C1CCC(CN2CCNCC2)CC1
InChIKey: LRPGNFROBDUREU-UHFFFAOYSA-N
Summenformel: C11H22N2
Durchschnittliche Molmasse: 182,31 g/mol
Monoisotopische Masse: 182,1782987

Namen und Bezeichner

Bevorzugter Name: 1-(Cyclohexylmethyl)piperazine
IUPAC: 1-(cyclohexylmethyl)piperazine
Englischer Name: 1-(CYCLOHEXYLMETHYL)PIPERAZINE
Summenformel: C11H22N2
Molmasse: 182.31

Namen und Synonyme

1-(Cyclohexylmethyl)piperazine57184-23-3DTXSID60370998RefChem:226411DTXCID00322032625-574-5(1-Cyclohexylmethyl)piperazineMFCD010752371-cyclohexylmethylpiperazine(cyclohexylmethyl)piperazinePiperazine, 1-(cyclohexylmethyl)-1-cyclohexylmethyl-piperazine

Weitere Namen anzeigen

CyclohexylmethylpiperazineN-(Cyclohexylmethyl)piperazine1-(Cyclohexylmethyl)piperazine97%1-(Cyclohexylmethyl)piperazine 97%1-(CYCLOHEXYLMETHYL)PIPERAZINE ISO 9001：2015 REACH

1-cyclohexylmethyl piperazineSCHEMBL42121SCHEMBL508979(1-cyclohexyl-methyl)piperazineCyclohexylmethylpiperazine; 97%LRPGNFROBDUREU-UHFFFAOYSA-NSBB0561271-(Cyclohexylmethyl)piperazine, 97%

Datenbank-Bezeichner

CAS: 57184-23-3
PubChem CID: 2735885
DTXSID: DTXSID60370998
EC Number: 625-574-5

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2
Polarare Oberfläche (TPSA): 15,3 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 13
Formalladung: 0
Komplexität: 135

Physikochemische Eigenschaften

Siedepunkt: 230 · 230-231 °C(lit.)
Dichte: 0.938 g/mL · 0.938 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.4950(lit.)
Flammpunkt: 190 °F · 190 °F
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
Aggregatzustand: Liquid
pka: 9.26 · 9.26±0.10(Predicted)
Farbe: Colorless
CAS Datenbank: 57184 · 57184-23-3(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

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 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

wgk: 3
ridadr: NA 1993 / PGIII
hs_code: 2933599590
risk_code: 36/37/38
hazard_code: Xi
hazard_note: Irritant
safety_code: 26-36

Chemie und Industrie

Anwendungen

Verwenden1-(Cyclohexylmethyl)piperazine is a crucial compound that could be used as a pharmaceutical intermediate in pharmaceutical synthesis and scientific research.