Xanthylium, 9-(2,4-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt, sodium salt (1:1)
Grundinformationen
- CAS
65392-81-6- Standard-SMILES
CCN(CC)c1ccc2c(-c3ccc(C(=O)[O-])cc3C(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1.[Na+]- InChIKey
QSDRVNJWBDNNPE-UHFFFAOYSA-M- Summenformel
- C29H29N2NaO5
- Durchschnittliche Molmasse
- 508,5 g/mol
- Monoisotopische Masse
- 508,19741631
Namen und Bezeichner
- Bevorzugter Name
- Xanthylium, 9-(2,4-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt, sodium salt (1:1)
- IUPAC
- sodium 4-[3-(diethylamino)-6-diethylazaniumylidenexanthen-9-yl]benzene-1,3-dicarboxylate
Namen und Synonyme
Xanthylium, 9-(2,4-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt, sodium saltEINECS 265-730-6DTXSID7042512Xanthylium, 9-(2,4-dicarboxyphenyl)-3,6-bis(diethylamino)-, hydroxide, inner salt, sodium saltXanthylium, 9-(2,4-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt, sodium salt (1:1)Xanthylium, 9-(2,4-dicarboxyphenyl)-3,6-bis(diethylamino)-, hydroxide, inner salt, monosodium saltHydrogen 9-(2,4-dicarboxylatophenyl)-3,6-bis(diethylamino)xanthylium, sodium saltRefChem:902289DTXCID5022512265-730-665392-81-6QSDRVNJWBDNNPE-UHFFFAOYSA-M
Weitere Namen anzeigen
Sodium 4-[3,6-bis(diethylamino)xanthen-10-ium-9-yl]benzene-1,3-dicarboxylate
Datenbank-Bezeichner
- CAS
65392-81-6- PubChem CID
- 65231
- DTXSID
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 95,7 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 37
- Formalladung
- 0
- Komplexität
- 925
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
This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.
Warning
H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Xanthylium, 9-(2,4-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt, sodium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Irrit. 2 (66.7%)
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing InformationXanthylium, 9-(2,4-dicarboxyphenyl)-3,6-bis(diethylamino)-, inner salt, sodium salt (1:1): ACTIVE
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