6-Iodo-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Grundinformationen
- CAS
302949-02-6- Standard-SMILES
O=C(O)c1c[nH]c2ccc(I)cc2c1=O- InChIKey
MPPGVYGQCYVNRZ-UHFFFAOYSA-N- Summenformel
- C10H6INO3
- Durchschnittliche Molmasse
- 315,06 g/mol
- Monoisotopische Masse
- 314,93924
Namen und Bezeichner
- Bevorzugter Name
- 6-Iodo-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
- IUPAC
- 6-iodo-4-oxo-1H-quinoline-3-carboxylic acid
- Englischer Name
- 4-Hydroxy -6-iodoquinoline-3- carboxylic acid
- Summenformel
- C10H6INO3
- Molmasse
- 315.06
Namen und Synonyme
302949-02-66-iodo-4-oxo-1,4-dihydroquinoline-3-carboxylic acidRefChem:543468874-066-14-Hydroxy-6-iodoquinoline-3-carboxylic acid40107-06-06-iodo-4-oxo-1H-quinoline-3-carboxylic acidMFCD019122856-iodo-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid3-Quinolinecarboxylic acid, 1,4-dihydro-6-iodo-4-oxo-6-Iodo-4-oxo-1,4-dihydro-3-quinoline-carboxylic acidOprea1_053455
Weitere Namen anzeigen
4-Hydroxy-6-iodo-3-quinolinecarboxylic acid
AE-641/13516204CHEMBL217028SCHEMBL1618188SCHEMBL2479663MPPGVYGQCYVNRZ-UHFFFAOYSA-NCMA94902AB7320STL331867
Datenbank-Bezeichner
- CAS
302949-02-6、40107-06-0- PubChem CID
- 719683
- ChEMBL
CHEMBL217028- EC Number
- 809-274-3、874-066-1
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,5
- Polarare Oberfläche (TPSA)
- 66,4 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 340
Physikochemische Eigenschaften
- Siedepunkt
- 430.9 · 430.9±45.0 °C(Predicted)
- Dichte
- 2.04 · 2.040±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 6.44 · 6.44±0.10(Predicted)
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.；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
Hazard Classes and Categories
Acute Tox. 4 (100%)
Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- hs_code
- 2933499090
Chemie und Industrie
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