4-Chloro-3-methyl-1H-pyrazole-5-carboxylic acid
Grundinformationen
- CAS
29400-84-8- Standard-SMILES
Cc1[nH]nc(C(=O)O)c1Cl- InChIKey
FWSYEYQXPSSQMV-UHFFFAOYSA-N- Summenformel
- C5H5ClN2O2
- Durchschnittliche Molmasse
- 160,56 g/mol
- Monoisotopische Masse
- 160,0039551
Namen und Bezeichner
- Bevorzugter Name
- 4-Chloro-3-methyl-1H-pyrazole-5-carboxylic acid
- IUPAC
- 4-chloro-5-methyl-1H-pyrazole-3-carboxylic acid
- Englischer Name
- 4-chloro-3-methyl-1H-pyrazole-5-carboxylic acid(SALTDATA: FREE)
- Summenformel
- C5H5ClN2O2
- Molmasse
- 160.56
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
29400-84-8- PubChem CID
- 17688981
- ChEMBL
CHEMBL393062- EC Number
- 801-868-0
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,1
- Polarare Oberfläche (TPSA)
- 66 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 153
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)
Aggregated GHS information provided per 2 reports by companies from 2 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
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302
Chemie und Industrie
Anbieter16 Anbieter
Zugehörige Reaktionen
Notizen zur Verbindung
Wird geladen…