1-(1-Methyl-4-piperidinyl)piperazine

HCID 566324CAS 23995-88-2

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Grundinformationen

Standard-SMILES: CN1CCC(N2CCNCC2)CC1
InChIKey: OHUMKYGINIODOY-UHFFFAOYSA-N
Summenformel: C10H21N3
Durchschnittliche Molmasse: 183,29 g/mol
Monoisotopische Masse: 183,17354767

Namen und Bezeichner

Bevorzugter Name: 1-(1-Methyl-4-piperidinyl)piperazine
IUPAC: 1-(1-methylpiperidin-4-yl)piperazine
Englischer Name: 1-(1-Methyl-4-piperidinyl)piperazine
Summenformel: C10H21N3
Molmasse: 183.29

Namen und Synonyme

23995-88-21-(1-Methyl-4-piperidinyl)piperazine1-(1-methylpiperidin-4-yl)piperazineDTXSID80340653RefChem:419855DTXCID00291734607-300-61-(n-methylpiperidin-4-yl)piperazine1-(1-Methyl-piperidin-4-yl)-piperazineMFCD010751861-(1-methyl-4-piperidyl)piperazine1-(N-Methyl-piperidin-4-yl)piperazine

Weitere Namen anzeigen

1-(1-Methyl-4-piperidinyl)pip1-(1-Methyl-piperidin-4-yl)-piperaz1-(1-Methy-4-piperidinyl)piperazine

1-(N-Methylpiperidin-4-yl)piperazine;1-Methyl-4-piperazinopiperidinePiperazine, 1-(1-methyl-4-piperidinyl)-SCHEMBL43296SCHEMBL105570RARECHEM AH CK 0142(1-methyl-4-piperidyl)piperazineBUTTPARK 82\08-46

Datenbank-Bezeichner

CAS: 23995-88-2
PubChem CID: 566324
DTXSID: DTXSID80340653
EC Number: 607-300-6

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,2
Polarare Oberfläche (TPSA): 18,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 1
Schwere Atome: 13
Formalladung: 0
Komplexität: 146

Physikochemische Eigenschaften

Schmelzpunkt: 29 · 29-32℃
Siedepunkt: 99 °C/0.08mm · 99°C/0.08mm
Dichte: 0.99 g/ml · 0.99g/ml
Brechungsindex: 20 · n20/D 1.508
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
Löslichkeit: Chloroform (Slightly), Dichloromethane (Slightly), Methanol (Slightly)
Aggregatzustand: Liquid
pka: 9.28 · 9.28±0.10(Predicted)
Farbe: Clear colorless to slightly yellow
InChI: InChI=1S/C10H21N3/c1-12-6-2-10(3-7-12)13-8-4-11-5-9-13/h10-11H,2-9H2,1H3
InChIKey: OHUMKYGINIODOY-UHFFFAOYSA-N
SMILES: N1(C2CCN(C)CC2)CCNCC1
CAS Datenbank: 23995 · 23995-88-2(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H314 (97.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 6 notifications to the ECHA C&L Inventory.