ChemicalBook--->CAS DataBase List--->81213-52-7

81213-52-7

81213-52-7 Structure

81213-52-7 Structure
IdentificationBack Directory
[Name]

(1-Oxyl-2,2,5,5-tetramethyl--pyrroline-3-methyl) Methanethiosulfonate
[CAS]

81213-52-7
[Synonyms]

MTSSL
MTS (spin label)
(1-Oxyl-2,2,5,5-tetramethyl--pyrroline-3-methyl) Methanethiosulfonate
(1-Oxyl-2,2,5,5-tetramethyl-delta3-pyrroline-3-methyl)methanethiosulfonate
2,5-dihydro-2,2,5,5-tetramethyl-3-[[(methylsulfonyl)thio]methyl]-1H-Pyrrol-1-yloxy
MTSL (S-(2,2,5,5-TetraMethyl-2,5-Dihydro-1H-Pyrrol-3yl)Methyl Methanesulfonothioate
[Molecular Formula]

C10H18NO3S2-
[MDL Number]

29339900
[MOL File]

81213-52-7.mol
Chemical PropertiesBack Directory
[Appearance]

Light Yellow Powder
[Melting point ]

107-108°C
[storage temp. ]

Amber Vial, -20°C Freezer, Under Inert Atmosphere
[solubility ]

DMF: 30 mg/ml; DMSO: 30 mg/ml; DMSO:PBS (pH 7.2) (1:3): 0.25 mg/ml; Ethanol: 15 mg/ml
[form ]

Yellow crystalline solid.
[color ]

Yellow crystalline solid
[Stability:]

Light Sensitive
[InChI]

1S/C10H18NO3S2/c1-9(2)6-8(7-15-16(5,13)14)10(3,4)11(9)12/h6H,7H2,1-5H3
[InChIKey]

BLSCGBLQCTWVPO-UHFFFAOYSA-N
[SMILES]

[O]N1C(C)(C)C=C(C1(C)C)CSS(=O)(C)=O
Hazard InformationBack Directory
[Chemical Properties]

Light Yellow Powder
[Uses]

A highly reactive thiol-specific spin-label. A specific conformational probe of thiol site structure by virtue of its minimal rotational freedom and distance from the covalent disulfide linkage to the macromolecule under study.
[Definition]

ChEBI: (1-oxyl-2,2,5,5-tetramethylpyrroline-3-methyl)methanethiosulfonate is an aminooxyl that is pyrroline substituted by an oxidanediyl group at position 1, by methyl groups at positions 2, 2, 5 and 5, and by a [(methylsulfonyl)sulfanyl]methyl group at position 3. It is a highly reactive thiol-specific spin label. It has a role as a spin label. It is a member of aminoxyls, a thiosulfonate ester and a pyrroline.
[Biological Activity]

MTSSL is a cysteine-specificflexible disulfide bond forming paramagnetic nitroxide spin label probe. MTSSL is reported to be useful for investigating structural and conformational dynamics of membrane proteins and protein aggregation.
[storage]

+4°C
Safety DataBack Directory
[Safety Statements ]

24/25
[WGK Germany ]

WGK 3
[HS Code ]

29339900
[Storage Class]

11 - Combustible Solids
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