| Identification | Back Directory | [Name]
3-(3,4-DIMETHYL-BENZENESULFONYL)-PROPIONIC ACID | [CAS]
412936-84-6 | [Synonyms]
TIMTEC-BB SBB011829
3-(3,4-DIMETHYL-BENZENESULFONYL)-PROPIONIC ACID
Propanoic acid, 3-[(3,4-dimethylphenyl)sulfonyl]- | [Molecular Formula]
C11H14O4S | [MDL Number]
MFCD00450484 | [MOL File]
412936-84-6.mol | [Molecular Weight]
242.29 |
| Chemical Properties | Back Directory | [Boiling point ]
480.6±45.0 °C(Predicted) | [density ]
1.265±0.06 g/cm3(Predicted) | [form ]
solid | [pka]
3.80±0.10(Predicted) | [InChI]
1S/C11H14O4S/c1-8-3-4-10(7-9(8)2)16(14,15)6-5-11(12)13/h3-4,7H,5-6H2,1-2H3,(H,12,13) | [InChIKey]
BQBZVJSVOQMDRC-UHFFFAOYSA-N | [SMILES]
Cc1ccc(cc1C)S(=O)(=O)CCC(O)=O |
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