2-(2,4,5,7-Tetrabromo-6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid

https://huagongshe.com/de/chemical/11049

Identifikatoren & physikalische Daten

CAS No.	152-75-0
Summenformel	C20H8Br4O5
Durchschnittliche Molmasse	647,9 g/mol
Monoisotopische Masse	643,71052 g/mol
SMILES	O=C(O)c1ccccc1-c1c2cc(Br)c(=O)c(Br)c-2oc2c(Br)c(O)c(Br)cc12
InChIKey	AZXGXVQWEUFULR-UHFFFAOYSA-N
PubChem CID	11049
ChEMBL	CHEMBL376503
ChEBI	CHEBI:86277
EC No.	611-203-4
DTXSID	DTXSID8074651

Chemische & physikalische Eigenschaften

XLogP	5,6
Polarare Oberfläche (TPSA)	83,8
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	5
Frei drehbare Bindungen	2
Schwere Atome	29
Formalladung	0
Komplexität	848
Endocrine Disruptors	Potential endocrine disrupting compound

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.WarningH319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P203, P264+P265, P280, P305+P351+P338, P318, P337+P317, 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.
Regulatorische Informationen	C.I. Acid red 87: Does not have an individual approval but may be used under an appropriate group standard

GHS-Einstufung

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.WarningH319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P203, P264+P265, P280, P305+P351+P338, P318, P337+P317, 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.

Regulatorische Informationen

C.I. Acid red 87: Does not have an individual approval but may be used under an appropriate group standard