1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid)

Basic Information

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CAS Number

81069-02-5

Molecular Formula

C14H16N2O14S4

Molecular Weight

564.55 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 Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Density

1.94

SMILES

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C1C(C(=O)N(C1=O)OC(=O)CCSSCCC(=O)ON2C(=O)CC(C2=O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C14H16N2O14S4/c17-9-5-7(33(23,24)25)13(21)15(9)29-11(19)1-3-31-32-4-2-12(20)30-16-10(18)6-8(14(16)22)34(26,27)28/h7-8H,1-6H2,(H,23,24,25)(H,26,27,28)

InChIKey

VOTJUWBJENROFB-UHFFFAOYSA-N

LogP

-1.9049999999999967

Topological Polar Surface Area

236.09999999999994 Å²

Hydrogen Bond Donor/Acceptor

2 / 16

Complexity

1020

Synonyms & References

English

3,3'-Dithiobis(sulphosuccinimidyl propionate)
3,3'-Dithiobispropionic Acid Bis-sulfosuccinimidyl Ester Disodium Salt 90%
FT-0614095
SCHEMBL243172
3-pyrrolidinesulfonic acid, 1,1'-[dithiobis[(1-oxo-3,1-propanediyl)oxy]]bis[2,5-dioxo-
C93510
HY-126349
1,1'-{Disulfanediylbis[(1-oxopropane-3,1-diyl)oxy]}bis(2,5-dioxopyrrolidine-3-sulfonic acid)
Dtbssp
VOTJUWBJENROFB-UHFFFAOYSA-N
DTSSP Crosslinker
3-Pyrrolidinesulfonic acid, 1,1'-(dithiobis((1-oxo-3,1-propanediyl)oxy))bis(2,5-dioxo-
3,3'-dithiobis(sulfosuccinimidyl propionate)
DTSSP
DTXSID30276271
1-[3-[3-(2,5-dioxo-3-sulfopyrrolidin-1-yl)oxy-3-oxopropyl]disulfanylpropanoyloxy]-2,5-dioxopyrrolidine-3-sulfonic acid
1-a[3-a[3-a?2,5-adioxo-a?-asulfopyrrolidin-a?-ayl)oxy-a?-aoxopropyl]disulfanylpropanoyloxy]-a?,5-adioxopyrrolidine-a?-asulfonic acid
81069-02-5
1-[3-[[3-(2,5-dioxo-3-sulfopyrrolidin-1-yl)oxy-3-oxopropyl]disulfanyl]propanoyloxy]-2,5-dioxopyrrolidine-3-sulfonic acid
3,3'-Dithiobispropionic acid bis-sulfosuccinimidyl ester
AKOS015898342
DTXSID701001749
MFCD01861949
1,1'-((3,3'-Disulfanediylbis(propanoyl))bis(oxy))bis(2,5-dioxopyrrolidine-3-sulfonic acid)
85549-78-6
CS-0102759
3,3'-Dithiobis(sulfosuccinimidylpropionate)
(SCH2CH2CONHC8H17)2
3,3'-disulfanediylbis(N-octylpropanamide)
3,3'-dithiobis(N-octylpropionamide)
3,3-dithiobis(sulfosuccinimidyl propionate)

MDL Number

MFCD01861949

Customs Code

29309090

FAQ

What are the physical and chemical properties of 1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) (CAS: 81069-02-5)?

1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) (CAS: 81069-02-5) is a crystalline compound with a high molecular weight. It has low solubility in water but good solubility in organic solvents. The compound is highly reactive, particularly towards nucleophiles and bases. It is stable under normal conditions but requires careful handling to avoid decomposition.

How is 1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) (CAS: 81069-02-5) typically synthesized?

1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) (CAS: 81069-02-5) is synthesized via a multi-step process involving the condensation of pyrrolidine derivatives, followed by sulfonation and coupling with disulfide. Commonly, the reaction is catalyzed by strong acids with high yield and selectivity.

What industries use 1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) (CAS: 81069-02-5)?

1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) (CAS: 81069-02-5) is used in pharmaceuticals for its high reactivity and stability. It is also employed in the production of polymers and as a component in sensors and semiconductors due to its unique chemical properties.

What precautions should be taken when handling 1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) (CAS: 81069-02-5)?

When handling 1,1'-{Disulfanediylbis[(1-oxo-3,1-propanediyl)oxy]}bis(2,5-dioxo-3-pyrrolidinesulfonic acid) (CAS: 81069-02-5), wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. Work in a well-ventilated area or a fume hood to avoid inhalation. Spills should be cleaned up immediately with appropriate absorbents. Refer to the safety data sheet (SDS) for detailed emergency procedures.