2-Methyl-5-phenyl-1,3-oxazole-4-carboxylic acid
Grundinformationen
- CAS
91137-53-0- Standard-SMILES
Cc1nc(C(=O)O)c(-c2ccccc2)o1- InChIKey
GEAPKHXZFUKEDK-UHFFFAOYSA-N- Summenformel
- C11H9NO3
- Durchschnittliche Molmasse
- 203,19 g/mol
Namen und Bezeichner
- Bevorzugter Name
- 2-Methyl-5-phenyl-1,3-oxazole-4-carboxylic acid
- IUPAC
- 2-methyl-5-phenyl-1,3-oxazole-4-carboxylic acid
Namen und Synonyme
91137-53-02-methyl-5-phenyl-1,3-oxazole-4-carboxylic acidRefChem:475736850-376-22-methyl-5-phenyloxazole-4-carboxylic acid2-methyl-5-phenyl-4-oxazolecarboxylic acidSCHEMBL1167223GEAPKHXZFUKEDK-UHFFFAOYSA-NRDA13753MFCD16989034AKOS023093675SY156465
Weitere Namen anzeigen
2-methyl-5-phenyloxazole-4-carboxylicacidDB-3385972-methyl-5-phenyl-oxazole-4-carboxylic acid5-phenyl-2-methyl-oxazole-4-carboxylic acidEN300-135569G60076Z1508919992
Datenbank-Bezeichner
- CAS
91137-53-0- PubChem CID
- 15630344
- EC Number
- 850-376-2
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,3
- Polarare Oberfläche (TPSA)
- 63,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 238
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Zugehörige Reaktionen
17
Notizen zur Verbindung
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