Grundinformationen
- Standard-SMILES
N#Cc1ccc(F)c2ccccc12- InChIKey
XQSGYYNFKIQWAC-UHFFFAOYSA-N- Summenformel
- C11H6FN
- Durchschnittliche Molmasse
- 171,17 g/mol
- Monoisotopische Masse
- 171,04842741
Namen und Bezeichner
- Bevorzugter Name
- 1-Cyano-4-fluoronaphthalene
- IUPAC
- 4-fluoronaphthalene-1-carbonitrile
- Englischer Name
- 1-CYANO-4-FLUORONAPHTHALENE
- Summenformel
- C11H6FN
- Molmasse
- 171.17
Namen und Synonyme
1-Cyano-4-fluoronaphthalene13916-99-9DTXSID60371561RefChem:229599DTXCID803225954-Fluoro-1-naphthonitrile4-fluoronaphthalene-1-carbonitrileMFCD002366561-Naphthalenecarbonitrile, 4-fluoro-C11H6FN4-fluoro-1-naphthalenecarbonitrile4-fluoronaphthalenecarbonitrile
Weitere Namen anzeigen
4-Fluoronaphthalene-1-carbonitrile, 97%
4-Fluoronaphthalene-1-carbonitrile, 1-Cyano-4-fluoronaphthalene4-Fluoro-1-naphthonitrile 97%1-cyano-4-fluoronapthalene4-cyano-1-fluoronaphthaleneSCHEMBL1363490BUTTPARK 11\09-58XQSGYYNFKIQWAC-UHFFFAOYSA-N4-Fluoro-naphthalene-1-carbonitrile
Datenbank-Bezeichner
- CAS
13916-99-9- PubChem CID
- 2736734
- DTXSID
DTXSID60371561- EC Number
- 670-852-1
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3
- Polarare Oberfläche (TPSA)
- 23,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 229
Physikochemische Eigenschaften
- Schmelzpunkt
- 89 · 89-91°C
- Siedepunkt
- 314.9 · 314.9±15.0 °C(Predicted)
- Dichte
- 1.22 · 1.22±0.1 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Aggregatzustand
- powder
- Farbe
- Mauve to grey
- CAS Datenbank
- 13916 · 13916-99-9(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H301 (20%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 3 (20%)
Sicherheitsdaten
- ridadr
- 3439
- hs_code
- 2926907090
- risk_code
- 20/21/22
- hazard_code
- T
- hazard_note
- Toxic
- safety_code
- 26-36/37/39
- hazard_class
- 6.1
- packing_group
- III
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