2-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride

HCID 57445256CAS 741736-98-1

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Grundinformationen

Standard-SMILES: Cl.FC(F)(F)c1ccc2c(n1)CCNC2
InChIKey: CZBDSVSNEMGVSY-UHFFFAOYSA-N
Summenformel: C9H10ClF3N2
Durchschnittliche Molmasse: 238,64 g/mol
Monoisotopische Masse: 238,04846066

Namen und Bezeichner

Bevorzugter Name: 2-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride
IUPAC: 2-(trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine;hydrochloride
Englischer Name: 2-(trifluoroMethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride
Summenformel: C9H10ClF3N2
Molmasse: 238.64

Namen und Synonyme

2-(trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochlorideRefChem:462523874-319-6741736-98-1MFCD205287172-(trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine;hydrochloride2-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine HClSCHEMBL3881128DTXSID707265232-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridinehydrochlorideAKOS016015149BS-49946

Weitere Namen anzeigen

DB-302015CS-0157262EN300-9342232Z30692815992-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine, hydrochloride2-trifluoromethyl-5,6,7,8-tetrahydro-[1,6]naphthyridine hydrochloride2-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine--hydrogen chloride (1/1)

Datenbank-Bezeichner

CAS: 741736-98-1
PubChem CID: 57445256
DTXSID: DTXSID70726523
EC Number: 874-319-6

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 24,9 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 0
Schwere Atome: 15
Formalladung: 0
Komplexität: 205

Physikochemische Eigenschaften

storage temp.: 2 · 2-8°C(protect from light)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.