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91950-41-3

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91950-41-3 Structure

91950-41-3 Structure
IdentificationBack Directory
[Name]

Benzenesulfonic acid, 1,1-dimethylethyl ester
[CAS]

91950-41-3
[Synonyms]

Atracurium Impurity 43
tert-Butyl Benzenesulfonate
Benzenesulfonic acid, 1,1-dimethylethyl ester
[Molecular Formula]

C10H14O3S
[MOL File]

91950-41-3.mol
[Molecular Weight]

214.28
Chemical PropertiesBack Directory
[Boiling point ]

300.7±11.0 °C(Predicted)
[density ]

1.145±0.06 g/cm3(Predicted)
[InChI]

InChI=1S/C10H14O3S/c1-10(2,3)13-14(11,12)9-7-5-4-6-8-9/h4-8H,1-3H3
[InChIKey]

WDFTWKQHSSVVJK-UHFFFAOYSA-N
[SMILES]

C1(S(OC(C)(C)C)(=O)=O)=CC=CC=C1
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