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ChemicalBook--->CAS DataBase List--->111-17-1

111-17-1

111-17-1 Structure

111-17-1 Structure
IdentificationMore
[Name]

3,3'-Thiodipropionic acid
[CAS]

111-17-1
[Synonyms]

3,3'-THIODIPROPIONIC ACID
3,3-THIODIPROPIONIC ACID
3,3'-THIODIPROPIONIC ACID, POLYMER-BOUND
BETA,BETA'-THIODIPROPIONIC ACID
BIS(2-CARBOXYETHYL) SULFIDE
DIETHYL SULFIDE 2,2'-DICARBOXYLIC ACID
LABOTEST-BB LT00254336
RARECHEM AL BO 0314
THIODIHYDRACRYLIC ACID
THIODIPROPIONIC ACID
2-(2,3,5,6-Tetramethylphenoxy)propionic acid
3,3’-thiobis(propanoicacid)
3,3’-thiobis-propanoicaci
3,3’-thiobis-Propanoicacid
3,3’-thiodi-propionicaci
3,3'-Thiobis-propanoic acid
3,3'-Thiodipropanoic acid
4-Thiaheptanedioic acid
4-thiaheptanedioicacid
acidethiodi-3,3’-propionique
[EINECS(EC#)]

203-841-3
[Molecular Formula]

C6H10O4S
[MDL Number]

MFCD00002781
[Molecular Weight]

178.21
[MOL File]

111-17-1.mol
Chemical PropertiesBack Directory
[Definition]

A dicarboxylic acid.
[Appearance]

WHITE FINE CRYSTALLINE POWDER
[Melting point ]

131-134 °C(lit.)
[Boiling point ]

280.43°C (rough estimate)
[density ]

1.238 (estimate)
[vapor pressure ]

0.004Pa at 25℃
[refractive index ]

1.5500 (estimate)
[Fp ]

128 °C
[storage temp. ]

Store below +30°C.
[solubility ]

40g/l
[form ]

Fine Crystalline Powder
[pka]

pK1:4.085;pK2:5.075 (18°C)
[color ]

White
[Water Solubility ]

40 g/L (25 ºC)
[Merck ]

14,9332
[BRN ]

1210299
[InChIKey]

ODJQKYXPKWQWNK-UHFFFAOYSA-N
[Uses]

Thiodipropionic Acid is an antioxidant used to prevent fats and oils from going rancid. It has the same functionality as bha, bht, and propyl gallate.
[CAS DataBase Reference]

111-17-1(CAS DataBase Reference)
[NIST Chemistry Reference]

[EPA Substance Registry System]

111-17-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R36:Irritating to the eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

2
[RTECS ]

UF7990000
[TSCA ]

Yes
[HS Code ]

29309070
[Hazardous Substances Data]

111-17-1(Hazardous Substances Data)
[Toxicity]

LD50 orally in Rabbit: 3000 mg/kg
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

Dilauryl thiodipropionate-->Distearyl thiodipropionate-->Tetrahydrothiopyran-4-one-->Dihexyl 3,3'- thiodipropionate
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3,3'-Thiodipropionic acid(111-17-1).msds
Hazard InformationBack Directory
[Chemical Properties]

3,3'-Thiodipropionic acid is WHITE FINE CRYSTALLINE POWDER
[Hazard]

Use in foods restricted to 0.02% of fat and oil content, including essential oils.
[Flammability and Explosibility]

Notclassified
[Safety Profile]

A poison by intraperitoneal andintravenous routes. Moderately toxic by ingestion. A skinand eye irritant. When heated to decomposition it emitstoxic fumes of SOx.
[Purification Methods]

Crystallise the sulfide from water. [Beilstein 3 IV 735.]
Spectrum DetailBack Directory
[Spectrum Detail]

3,3'-Thiodipropionic acid(111-17-1)MS
3,3'-Thiodipropionic acid(111-17-1)1HNMR
3,3'-Thiodipropionic acid(111-17-1)13CNMR
3,3'-Thiodipropionic acid(111-17-1)IR1
3,3'-Thiodipropionic acid(111-17-1)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

[Alfa Aesar]

[Sigma Aldrich]

111-17-1(sigmaaldrich)
[TCI AMERICA]

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