Bromocresol Green Sodium Salt Solution CAS #: 62625-32-5

Synonyms Bromocresol Green Sodium Salt; PBTBO; 3', 3'', 5', 5''-Tetrabromo-m-cresolsulfonephthalein sodium salt; sodium α-(3, 5-dibromo-2-methyl-4-oxo-2, 5-cyclohexadienylidene)-α-(3, 5-dibromo-4-hydroxyphenyl)toluenesulphonate; Phenol, 4, 4'-(2, 2-dioxido-3H-1, 2-benzoxathiol-3-ylidene)bis(2, 6-dibromo-3-methyl-, monosodium salt; Sodium alpha-(3, 5-dibromo-2-methyl-4-oxo-2, 5-cyclohexadienylidene)-alpha-(3, 5-dibromo-4-hydroxyphenyl)toluenesulphonate; Sodium 2, 6-dibromo-4-[3-(3, 5-dibromo-4-hydroxy-2-methylphenyl)-2, 2-dioxido-3H-1, 2-benzoxathiol-3-yl]-3-methylphenolate

Compound Formula: C12H13Br4O5SNa Molecular Weight: 720 Appearance: Dark green to blue liquid Melting Point: 230 °C Boiling Point: N/A Density: 0.991 g/mL Solubility in H2O: N/A Exact Mass: 719.707394 Monoisotopic Mass: 715.711487

Health & Safety Information Signal Word: N/A Hazard Statements: N/A Hazard Codes: N/A Risk Codes: N/A Safety Statements: N/A Transport Information: N/A

Chemical Identifiers Linear Formula: C12H13Br4O5SNa Pubchem CID: 4160768 MDL Number: MFCD00148898 EC No.: 263-657-4 IUPAC Name: sodium; 2-[(3,5-dibromo-4-hydroxy-2-methylphenyl)-(3,5-dibromo-2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate Beilstein/Reaxys No.: N/A SMILES: CC1=C(C(=C(C=C1C(=C2C=C(C(=O)C(=C2C)Br)Br)C3=CC=CC=C3S(=O)(=O)[O-])Br)O)Br.[Na+] InchI Identifier: InChI=1S/C21H14Br4O5S.Na/c1-9-12(7-14(22)20(26)18(9)24)17(11-5-3-4-6-16(11)31(28,29)30)13-8-15(23)21(27)19(25)10(13)2;/h3-8,26H,1-2H3,(H,28,29,30);/q;+1/p-1 InchI Key: PZBRPDUUWGYUTE-VSORCOHTSA-M