1'-(Phenylmethyl)-[1,4'-bipiperidin]-4'-carboxamid

1'-Benzyl-[1,4'-bipiperidine]-4'-carboxamide · 1-(benzyl)-4-piperidino-isonipecotamide · 1'-Benzyl-1,4'-bipiperidine-4'-carboxamide · 1-Benzyl-4-carbaMoyl-4-piperidinopiperidine · 1-Benzyl-4-piperidino-4-piperidinecarboxamide · 1'-(phenylmethyl)-[1,4'-bipiperidine]-4'-carboxamide · [1,4'-Bipiperidine]-4'-carboxamide, 1'-(phenylmethyl)- · 1-(phenylmethyl)-4-piperidin-1-ylpiperidine-4-carboxamide

https://huagongshe.com/de/chemical/74480

Molekülstruktur von 1'-(Phenylmethyl)-[1,4'-bipiperidin]-4'-carboxamid

Identifikatoren & physikalische Daten

CAS No.	1762-50-1
Summenformel	C18H27N3O
Durchschnittliche Molmasse	301,4 g/mol
Monoisotopische Masse	301,21541249 g/mol
SMILES	NC(=O)C1(N2CCCCC2)CCN(Cc2ccccc2)CC1
InChIKey	YKESGDAJVLVZAA-UHFFFAOYSA-N
PubChem CID	74480
ChEMBL	CHEMBL1584435
EC No.	217-173-5
DTXSID	DTXSID20170097
Lokaler Name	1'-(Phenylmethyl)-[1,4'-bipiperidin]-4'-carboxamid

Chemische & physikalische Eigenschaften

XLogP	1,9
Polarare Oberfläche (TPSA)	49,6
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	4
Schwere Atome	22
Formalladung	0
Komplexität	365
Schmelzpunkt	142-145°C
Siedepunkt	467.7±45.0 °C(Predicted)
Dichte	1.142±0.06 g/cm3(Predicted)
Lagerbedingungen	Refrigerator
Löslichkeit	Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand	Solid
pKa (Säurekonstante)	16.20±0.20(Predicted)
Farbe	Off-White to Pale Yellow

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Regulatorische Informationen	REACH registered substance: 1'-(phenylmethyl)-[1,4'-bipiperidine]-4'-carboxamide (EC: 217-173-5)
Hazard Classes and Categories	Acute Tox. 4 (100%)
Alarmwort	Warnung
Gefahrenhinweise	Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302

Anwendungen & Verwendung

Verwenden

Piritramide intermediate.