Bromocresol Purple

BCP · bromocresol · BROMCRESOL PURPLE · BROMOCRESOL PURPLE SOLUTION · 4,4’-(3h-2,1-benzoxathiol-3-ylidene)bis(2-bromo-6-methylphenol)s,s-dioxide · Nsc 374134 · M.W. 540.24 · Bromocresolred

https://huagongshe.com/de/chemical/8273

Identifikatoren & physikalische Daten

CAS No.	115-40-2
Summenformel	C21H16Br2O5S
Durchschnittliche Molmasse	540,2 g/mol
Monoisotopische Masse	537,90851881 g/mol
SMILES	Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O
InChIKey	ABIUHPWEYMSGSR-UHFFFAOYSA-N
PubChem CID	8273
ChEBI	CHEBI:86154
EC No.	204-087-8
DTXSID	DTXSID3059428

Chemische & physikalische Eigenschaften

XLogP	5,1
Polarare Oberfläche (TPSA)	92,2
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	5
Frei drehbare Bindungen	2
Schwere Atome	29
Formalladung	0
Komplexität	680
Stoffklassen	Dyes -> Indicator Dyes
Color/Form	Minute, slightly yellow crystals
Löslichkeit	Soluble in alcohol, dilute alkaliesethanol: soluble1mg/mLpractically insoluble
Schmelzpunkt	241.5 °C240 °C (dec.) (lit.)
Physical Description	Odorless, pale-yellow to purple solidAvailable as pure compound, monosodium salt, and dilute solutions[CHEMINFO]
Dissociation Constants	pKa = 6.3
Dichte	1.6509 (estimate)
Flammpunkt	36 °C
Lagerbedingungen	Store at +5°C to +30°C.
pKa (Säurekonstante)	6.21, 6.3, 6.4(at 25℃)
Aggregatzustand	Solid
Siedepunkt	590.2±50.0 °C(Predicted)
Farbe	Purplish-brown
pH	pH : 5.2~6.8
Merck	14,1387
BRN	359618
Henry-Konstante	9.9×1012 mol/(m3Pa) at 25℃, HSDB (2015)
Stabilität	Stable. Incompatible with strong oxidizing agents.
Hauptanwendungen	Waveguides, fuel cells, sensors, sol-gel technology, display device, falsification-proof security paper, paints, detergents, identifying fresh and stale rice, detecting lactic acid bacteria, dental materials, vaginal infection test method
InChI	1S/C21H16Br2O5S/c1-11-7-13(9-16(22)19(11)24)21(14-8-12(2)20(25)17(23)10-14)15-5-3-4-6-18(15)29(26,27)28-21/h3-10,24-25H,1-2H3
InChIKey	ABIUHPWEYMSGSR-UHFFFAOYSA-N
SMILES	Cc1cc(cc(Br)c1O)C2(OS(=O)(=O)c3ccccc23)c4cc(C)c(O)c(Br)c4
CAS Datenbank	115-40-2(CAS DataBase Reference)
EPA chemische Informationen	Bromcresol Purple (115-40-2)

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 6.9% (7 of 101) of reports.WarningH315 (93.1%): 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)Aggregated GHS information provided per 101 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Regulatorische Informationen	Chemical: Phenol, 4,4'-(3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, S,S-dioxideHazard Traits - BioaccumulationEnvironmental PersistencePhenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-: Does not have an individual approval but may be used under an appropriate group standard
Weitere Sicherheitsinformationen	IMAP assessments - Phenol, 4,4'-(3H-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-methyl-, S,S-dioxide: Human health tier I assessment
Gefahrenübersicht	Dust may be irritating if inhaled[CHEMINFO]
Hazard Classes and Categories	Skin Irrit. 2 (93.1%)
Skin, Eye, and Respiratory Irritations	May cause respiratory tract irritation. May be harmful if absorbed through skin. May cause skin irritation. May cause eye irritation.
Hazardous Reactivities and Incompatibilities	Materials to avoid: Strong oxidizing agents.
Brandbekämpfungsverfahren	Suitable extinguishing media: Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide. Special protective equipment for fire-fighters: Wear self contained breathing apparatus for fire fighting if necessary.Special protective equipment for fire-fighters: Wear self contained breathing apparatus for fire fighting if necessary.
Lagerbedingungen	Keep container tightly closed in a dry and well-ventilated place.

Anwendungen & Verwendung

Verwenden

Bromocresol purple has been used as a pH indicator in the yeast culture media. It has been used as a pH indicator in the culture media of Geobacillus stearothermophilus subsp. Calidolactis.