1,3-Propanediyl bis(4-methylbenzenesulfonate)

Basic Information

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CAS Number

5469-66-9

Molecular Formula

C17H20O6S2

Molecular Weight

384.48 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

90.0 to 93.0 deg-C

Boiling Point

563.1°C at 760 mmHg

Density

1.3

Flash Point

294.4°C

Refractive Index

1.56

SMILES

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CC1=CC=C(C=C1)S(=O)(=O)OCCCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H20O6S2/c1-14-4-8-16(9-5-14)24(18,19)22-12-3-13-23-25(20,21)17-10-6-15(2)7-11-17/h4-11H,3,12-13H2,1-2H3

InChIKey

ODVREDGIWSDQFD-UHFFFAOYSA-N

LogP

2.8043400000000016

Topological Polar Surface Area

86.74000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

532

Synonyms & References

English

3-(4-methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate
1,3-Propanediol Ditosylate
propane-1.3-diyl bis(4-methylbenzenesulfonate)
propane-1,3-di-Tos
1,3-propanediyl di-p-toluenesulphonate
SCHEMBL483847
propane-1,3-diylbis(4-methylbenzenesulfonate)
1,3-Bis(tosyloxy)propane
1,3-(Di-p-tosyl)propane
CS-W011753
1,3-PROPANEDIOLDI-P-TOLUENESULFONATE
1,3-propanediol bis(4-methylbenzenesulfonate)
3-([(4-Methylphenyl)sulfonyl]oxy)propyl 4-methylbenzenesulfonate #
NSC25205
1,3-Propanediol di-p-toluenesulfonate
F16767
1,3-Propanediol-di-4-tosylate
1,3-di(p-toluenesulfonyloxy)propane
3-[(4-methylbenzenesulfonyl)oxy]propyl 4-methylbenzene-1-sulfonate
1,3-Propanediol di-p-tosylate
propane-1,3-diyl bis(4-methylbenzenesulfonate)
B1875
NSC 25205
1,3-Propanediol di-p-tosylate, 98%
BP-23628
MFCD00013392
1,3-Bis(p-toluenesulfonyloxy)propane
5469-66-9
AS-10566
FT-0635749
Z56755923

MDL Number

MFCD00013392

Customs Code

2905199090

FAQ

What regulatory guidelines apply to 1,3-Propanediyl bis(4-methylbenzenesulfonate) (CAS: 5469-66-9)?

1,3-Propanediyl bis(4-methylbenzenesulfonate) (CAS: 5469-66-9) falls under the scope of various regulatory guidelines including the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in Europe, and FDA/EPA requirements for chemical safety. It is important to follow these guidelines for proper labeling, storage, and disposal of the compound.

Are there alternatives to 1,3-Propanediyl bis(4-methylbenzenesulfonate) (CAS: 5469-66-9) in synthesis?

Alternative reagents such as 1,3-propanediyl bis(4-toluenesulfonate) or 1,3-propanediyl bis(3-methylbenzenesulfonate) can be considered as substitutes in synthesis. These alternatives may offer similar functionality but with different physical and chemical properties, depending on the specific application requirements.

What is the market or research trend for 1,3-Propanediyl bis(4-methylbenzenesulfonate) (CAS: 5469-66-9)?

The market for 1,3-Propanediyl bis(4-methylbenzenesulfonate) (CAS: 5469-66-9) is driven by its use in various applications including pharmaceuticals, dyes, and plastics. Research trends are focused on exploring its potential in new areas such as environmental remediation and advanced materials. The demand appears steady with minor fluctuations based on market trends and emerging technologies.

How should waste containing 1,3-Propanediyl bis(4-methylbenzenesulfonate) (CAS: 5469-66-9) be handled?

Waste containing 1,3-Propanediyl bis(4-methylbenzenesulfonate) (CAS: 5469-66-9) should be collected and stored in appropriate containers, ensuring containment to prevent environmental contamination. For disposal, it is recommended to use professional waste disposal services. Safe incineration or specialized chemical treatment methods can be employed to ensure the compound is rendered harmless and environmentally safe.