Grundinformationen
- CAS
3319-99-1- Standard-SMILES
c1ccc(-c2cccs2)nc1- InChIKey
QLPKTAFPRRIFQX-UHFFFAOYSA-N- Summenformel
- C9H7NS
- Durchschnittliche Molmasse
- 161,23 g/mol
- Monoisotopische Masse
- 161,0299204
Namen und Bezeichner
- Bevorzugter Name
- 2-(2'-Thienyl)pyridine
- IUPAC
- 2-thiophen-2-ylpyridine
- Lokaler Name
- 2-(2-Thienyl)pyridin
- Englischer Name
- 2-(2-THIENYL)PYRIDINE
- Summenformel
- C9H7NS
- Molmasse
- 161.22
Namen und Synonyme
2-(2'-Thienyl)pyridineRefChem:4544602-(Thiophen-2-yl)pyridine2-(2-Thienyl)pyridine3319-99-12-thien-2-ylpyridine2-thiophen-2-ylpyridine2-(2-Pyridyl)thiophene2-thiophen-2-yl-pyridineMFCD00044441Pyridine, 2-(2-thienyl)-2-(thien-2-yl)pyridine
Weitere Namen anzeigen
AKOS BAR-1355BUTTPARK 37\04-102-(2-Thienyl)pyridin2'-(2-thienyl)pyridine2-(2-Pyridinyl)thiophene
thienyl pyridine2-thienylpyridineEINECS 222-022-12-Pyrid-2-ylthiopheneSCHEMBL36011MLS000861939SCHEMBL295633SCHEMBL1201661
Datenbank-Bezeichner
- CAS
3319-99-1- PubChem CID
- 76832
- DTXSID
DTXSID90186842- ChEMBL
CHEMBL1883714- EC Number
- 222-022-1
- Nikkaji
- J150.008B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,2
- Polarare Oberfläche (TPSA)
- 41,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 127
Experimentelle und physikochemische Eigenschaften
Solubility1.9 [ug/mL] (The mean of the results at pH 7.4)
Physikochemische Eigenschaften
- Schmelzpunkt
- 61 · 61-63°C
- Siedepunkt
- 140 °C/16mmHg · 140°C/16mmHg(lit.)
- Dichte
- 1.173 · 1.173±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Löslichkeit
- soluble in Methanol
- Aggregatzustand
- powder to crystal
- pka
- 4.51 · 4.51±0.10(Predicted)
- Farbe
- Light orange to Yellow to Green
- BRN
- 508454 · 508454
- InChI
- InChI=1S/C9H7NS/c1-2-6-10-8(4-1)9-5-3-7-11-9/h1-7H
- InChIKey
- QLPKTAFPRRIFQX-UHFFFAOYSA-N
- SMILES
- C1(C2SC=CC=2)=NC=CC=C1
- LogP
- 2.702 · 2.702 (est)
- CAS Datenbank
- 3319 · 3319-99-1(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory Information2-(2-Thienyl)pyridine: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (97.9%)
Regulatorische Informationen
Regulatory Information2-(2-Thienyl)pyridine: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Sicherheitsdaten
- hs_code
- 29349990
- risk_code
- 36/37/38
- safety_code
- 26-36
- hazard_class
- IRRITANT
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