Grundinformationen
- Standard-SMILES
Cc1nn(C)c2ncc(C(=O)O)c(Cl)c12- InChIKey
LHEUUYZQYKWDSY-UHFFFAOYSA-N- Summenformel
- C9H8ClN3O2
- Durchschnittliche Molmasse
- 225,63 g/mol
- Monoisotopische Masse
- 225,03050418
Namen und Bezeichner
- Bevorzugter Name
- 4-Chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
- IUPAC
- 4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylic acid
- Englischer Name
- 4-CHLORO-1,3-DIMETHYLPYRAZOLO[3,4-B]PYRIDINE-5-CARBOXYLIC ACID
- Summenformel
- C9H8ClN3O2
- Molmasse
- 225.63
Namen und Synonyme
175201-94-24-Chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acidDTXSID903467424-Chloro-1,3-dimethyl-1H-pyrazolo(3,4-b)pyridine-5-carboxylic acidRefChem:291270DTXCID20297814LHEUUYZQYKWDSY-UHFFFAOYSA-N4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylic acidMFCD000679594-chloro-1,3-dimethyl-1h-pyrazol[3,4-b]pyridine-5-carboxylic acidOprea1_4243891H-Pyrazolo[3,4-b]pyridine-5-carboxylic acid, 4-chloro-1,3-dimethyl-
Weitere Namen anzeigen
BUTTPARK 30\08-344-Chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-4-chloro-1,3-diMethylpyraazolo[3,4-B]pyridine-5-carboxylic acid4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxyli...4-Chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridin-5-carboxylic acid4-Chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid 97%
TD8049SY0973834-chloro-1,3-dimethylpyrazolo[5,4-b]pyridine-5-carboxylic acid4-Chloro-1,3-dimethyl-1H-pyrazolo-[3,4-b]pyridine-5-carboxylic acidAMY34958SCHEMBL2639271SBB096881AKOS015908974
Datenbank-Bezeichner
- CAS
175201-94-2- PubChem CID
- 614513
- DTXSID
DTXSID90346742- EC Number
- 673-096-0
- Nikkaji
- J2.079.859I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,4
- Polarare Oberfläche (TPSA)
- 68 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 276
Physikochemische Eigenschaften
- Schmelzpunkt
- 269 °C · 269 °C
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Aggregatzustand
- crystalline powder
- Farbe
- Off-white
- CAS Datenbank
- 175201 · 175201-94-2
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/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%)
Sicherheitsdaten
- hs_code
- 29333990
- risk_code
- 36/37/38-36
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36/37/39
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