Sodium 2-[(3-bromo-4-hydroxy-5-methylphenyl)(3-bromo-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]benzenesulfonate | CAS No. 62625-30-3

Sodium 2-[(3-bromo-4-hydroxy-5-methylphenyl)(3-bromo-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]benzenesulfonate

Basic Information

CAS Number

62625-30-3

Molecular Formula

C21H15Br2NaO5S

Molecular Weight

562.2 g/mol

AD

Basic Physical Properties

Melting Point

255 °C (dec.)

Boiling Point

590.2°Cat760mmHg

Density

0.991 g/mL at 25 °C

Flash Point

590.2°Cat760mmHg

Solubility

H2O: soluble

CC1=CC(=CC(=C1O)Br)C(=C2C=C(C(=O)C(=C2)Br)C)C3=CC=CC=C3S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C21H16Br2O5S.Na/c1-11-7-13(9-16(22)20(11)24)19(14-8-12(2)21(25)17(23)10-14)15-5-3-4-6-18(15)29(26,27)28;/h3-10,24H,1-2H3,(H,26,27,28);/q;+1/p-1

InChIKey

KVSJYIXUWNOWBD-UHFFFAOYSA-M

LogP

6.05770

pKa

6.3, 6.12(at 25℃)

Complexity

874

Safety Information

View Safety Information

GHS Hazard Pictograms

H315H315
H319H319
H335H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • AKOS015964137
  • Bromocresol Purple sodium salt
  • AKOS024282612
  • AC-18342
  • 5',5''-Dibromo-o-cresolsulfonphthalein sodium salt
  • Sodium Bromocresol Purple
  • AMY22378
  • EINECS 305-043-1
  • 94333-63-8
  • AKOS030255671
  • 5',5''-Dibromo-o-cresolsulfonephthalein sodium salt
  • Bromocresol Purple sodium salt, 0.04% w/v aq. soln.
  • sodium;2-[(E)-(3-bromo-4-hydroxy-5-methylphenyl)-(3-bromo-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonate
  • bromocresol-purple sodium-salt
  • 62625-30-3
  • Sodium 2-((3-bromo-4-hydroxy-5-methylphenyl)(3-bromo-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl)benzenesulphonate
  • Bromocresol purple sodium salt
  • BCP
  • -(3-bromo-5-methyl-4-hydroxyphenyl)toluenesulphonate
  • -(3-bromo-5-methyl-4-oxo-2,5-cyclohexadienylidene)-&#x3B1
  • 5-BroMosalicylic acid
  • BROMCRESOL PURPLE
  • BROMCRESOL PURPLE SODIUM
  • BROMCRESOL PURPLE SOLUTION 0. AQUEOUS
  • BROMCRESOL PURPLE,SODIUM SALT
  • BroMocresol Purple, sodiuM salt, pure, water soluble, indicator
  • BROMOCRESOL PURPLE,WATER SOLUBLE
  • BROMOCRESOL PURPLE,WATER SOLUBLE,REAG.
  • sodium &#x3B1
  • 5′,5″-Dibromo-o-cresolsulfonphthalein sodium salt
  • 5′,5′′-Dibromo-o-cresolsulfonephthalein sodium salt

MDL Number

MFCD00148896

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