Grundinformationen
- Standard-SMILES
c1cc(-c2nnc3n2CCNC3)ccn1- InChIKey
GNZXCVATTPQTRU-UHFFFAOYSA-N- Summenformel
- C10H11N5
- Durchschnittliche Molmasse
- 201,23 g/mol
- Monoisotopische Masse
- 201,10144537
Namen und Bezeichner
- Bevorzugter Name
- 3-(Pyridin-4-yl)-5,6,7,8-tetrahydro-(1,2,4)triazolo(4,3-a)pyrazine
- IUPAC
- 3-pyridin-4-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
Namen und Synonyme
945262-29-33-(Pyridin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine3-(Pyridin-4-yl)-5,6,7,8-tetrahydro-(1,2,4)triazolo(4,3-a)pyrazineRefChem:496086821-008-84-{5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl}pyridineSCHEMBL108722GNZXCVATTPQTRU-UHFFFAOYSA-NAKOS011879422SDCCGSBI-0663068.P001DB-413299EN300-112968
Weitere Namen anzeigen
3-(4-Pyridinyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine3-pyridin-4-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine5,6,7,8-tetrahydro-3-(4-pyridinyl)-1,2,4-Triazolo[4,3-a]pyrazine
Datenbank-Bezeichner
- CAS
945262-29-3- PubChem CID
- 62587692
- EC Number
- 821-008-8
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -0,9
- Polarare Oberfläche (TPSA)
- 55,6 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 216
Sicherheit und Regulatorisches
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 (100%): 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Zugehörige Reaktionen
3
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