4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol)

Basic Information

View in Editor

CAS Number

2800-80-8

Molecular Formula

C19H12Br2O5S

Molecular Weight

512.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

>250°C

Boiling Point

586.8°C at 760 mmHg

Density

1.8810

Flash Point

308.7°C

Solubility

Solubility Sparingly soluble in water; soluble in ethanol

Refractive Index

1.722

SMILES

View in Editor

C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC(=C(C=C3)O)Br)C4=CC(=C(C=C4)O)Br

InChI

InChI=1S/C19H12Br2O5S/c20-14-9-11(5-7-16(14)22)19(12-6-8-17(23)15(21)10-12)13-3-1-2-4-18(13)27(24,25)26-19/h1-10,22-23H

InChIKey

OYCLSQDXZMROJK-UHFFFAOYSA-N

LogP

4.633600000000003

pKa

6.51(at 25℃)

Topological Polar Surface Area

83.83 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

625

Synonyms & References

English

4,4'-(3H-2,1-Benzoxathiol-3-ylidene)bis(2-bromophenol), S,S-dioxide
Bromophenol red (sultone form)
BromophenolRed
DTXSID50182284
NS00028403
AKOS015903430
FT-0623212
Bromphenolrot
Bromophenol red
Q904434
B-8961
2-bromo-4-[3-(3-bromo-4-hydroxyphenyl)-1,1-dioxo-2,1lambda6-benzoxathiol-3-yl]phenol
T70710
MFCD00023014
SCHEMBL4949654
B0632
Bromophenol red Sultone Form
EINECS 220-538-1
RCL L132012
2800-80-8
Bromophenol Red
2-bromo-4-[3-(3-bromo-4-hydroxyphenyl)-1,1-dioxo-2,1λ<sup>6</sup>-benzoxathiol-3-yl]phenol
BROMOPHENOL RED INDICATOR
2,3-Dibromophenol
3,3-Bis-(3-brom-4-hydroxy-phenyl)-3H-benz[c][1,2]oxathiol-1,1-dioxid
3,3-bis-(3-bromo-4-hydroxy-phenyl)-3H-benz[c][1,2]oxathiol-1,1-dioxide
4,4'-(1,1-dioxido-3h-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol)
Barbituric acid
BPR
bromocresol red
Bromophenol Red, pure

MDL Number

MFCD11042277

Customs Code

29349990

FAQ

What is 4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol) (CAS: 2800-80-8)?

4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol) (CAS: 2800-80-8) is a complex organic compound with a molecular structure that includes bromine and a benzoxathiole ring system. It is highly reactive and may be used in various chemical synthesis processes.

What are the main uses of 4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol) (CAS: 2800-80-8)?

This compound is used primarily in the synthesis of other organic compounds, including pharmaceuticals and materials. It may also find applications in industry for specific chemical reactions and processes.

Is 4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol) (CAS: 2800-80-8) safe?

4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol) (CAS: 2800-80-8) is not considered safe for direct human contact or ingestion. It is highly reactive and requires appropriate handling and protective measures to minimize risks.

How should 4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol) (CAS: 2800-80-8) be stored?

4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2-bromophenol) (CAS: 2800-80-8) should be stored in a cool, dry environment away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent exposure to air and moisture.