| Identification | Back Directory | [Name]
5-mercapto-2-methoxy-4-methylbenzoic acid | [CAS]
439579-12-1 | [Synonyms]
5-mercapto-2-methoxy-4-methylbenzoic acid Benzoic acid, 5-mercapto-2-methoxy-4-methyl- | [EINECS(EC#)]
604-604-1 | [Molecular Formula]
C9H10O3S | [MDL Number]
MFCD09831918 | [MOL File]
439579-12-1.mol | [Molecular Weight]
198.24 |
| Chemical Properties | Back Directory | [Boiling point ]
379.6±42.0 °C(Predicted) | [density ]
1.280±0.06 g/cm3(Predicted) | [storage temp. ]
2-8°C, stored under nitrogen | [pka]
4.01±0.10(Predicted) | [Appearance]
Off-white to yellow Solid | [InChI]
InChI=1S/C9H10O3S/c1-5-3-7(12-2)6(9(10)11)4-8(5)13/h3-4,13H,1-2H3,(H,10,11) | [InChIKey]
XNKVDVNVKYMYFS-UHFFFAOYSA-N | [SMILES]
C(O)(=O)C1=CC(S)=C(C)C=C1OC |
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