CAS 155766-33-9 (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine (HCID 10534891)

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Grundinformationen

CAS: 155766-33-9
Standard-SMILES: C=CCN1C[C@H](C)NC[C@H]1C
InChIKey: VKUXNUOPPQWDMV-DTWKUNHWSA-N
Summenformel: C9H18N2
Durchschnittliche Molmasse: 154,25 g/mol
Monoisotopische Masse: 154,14699858

Überblick

See also: 1-Allyl-trans-(2S,5R)-dimethylpiperazine (annotation moved to).

Namen und Bezeichner

Bevorzugter Name: (-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine
IUPAC: (2R,5S)-2,5-dimethyl-1-prop-2-enylpiperazine
Englischer Name: Piperazine, 2,5-dimethyl-1-(2-propenyl)-, (2R,5S)- (9CI)
Summenformel: C9H18N2
Molmasse: 154.25

Namen und Synonyme

(-)-(2R,5S)-1-Allyl-2,5-dimethylpiperazineRefChem:397667155836-78-5(2R,5S)-1-Allyl-2,5-dimethylpiperazine155766-33-9trans-1-allyl-2,5-dimethylpiperazine(2R,5S)-2,5-dimethyl-1-prop-2-enylpiperazine(2R,5S)-2,5-Dimethyl-1-(2-propen-1-yl)piperazine(2R,5S)-2,5-DIMETHYL-1-(PROP-2-EN-1-YL)PIPERAZINE(+/-)-TRANS-1-ALLYL-2 5-DIMETHYLPIPERAZSCHEMBL231228(2R-trans)-2,5-Dimethyl-1-(2-propenyl)piperazine

Weitere Namen anzeigen

(2R,5S)-2,5-DIMETHYL-1-PROP-2-EN-1-YLPIPERAZINEPiperazine, 2,5-dimethyl-1-(2-propen-1-yl)-, (2R,5S)-Piperazine, 2,5-dimethyl-1-(2-propenyl)-, (2R,5S)- (9CI)

VKUXNUOPPQWDMV-DTWKUNHWSA-NDTXSID401235781MFCD09753425AKOS006329024FA17303(2R, 5S)-1-allyl-2,5-dimethylpiperazineDB-246886CS-0447424

Datenbank-Bezeichner

CAS: 155766-33-9、155836-78-5

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,1
Polarare Oberfläche (TPSA): 15,3 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 11
Formalladung: 0
Komplexität: 134

Physikochemische Eigenschaften

storage temp.: -20 °C · -20°C Freezer
Löslichkeit: soluble in Dichloromethane, Methanol, Tetrahydrofuran
Aggregatzustand: Oil
Farbe: Light Yellow to light Orange

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.