5-(Carboxymethylsulfanylmethyl)-2-methoxybenzoic acid
5-(carboxymethylsulfanylmethyl)-2-methoxybenzoic acid
Also Known As: CBMicro_017720|Oprea1_795093|BIM-0017871.P001|5-(carboxymethylsulfanylmethyl)-2-methoxybenzoic acid|5-[(carboxymethylthio)methyl]-2-methoxybenzoic acid|5-{[(carboxymethyl)sulfanyl]methyl}-2-methoxybenzoic acid|5-(((carboxymethyl)thio)methyl)-2-methoxybenzoic acid
CAS: 91144-10-4
| Molecular Formula | C11H12O5S |
|---|---|
| Molecular Weight | 256.04056 g/mol |
| LogP | 1.7112 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 256.04056 |
| Monoisotopic Mass | 256.04056 |
| Heavy Atoms | 17 |
| Complexity | 429.87 |
Chemical Identifiers
| CAS Number | 91144-10-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CSCC(=O)O)C(=O)O |
Product Overview
5-(Carboxymethylsulfanylmethyl)-2-methoxybenzoic acid (CAS 91144-10-4), with molecular formula C11H12O5S and molecular weight 256.04056 g/mol. IUPAC: 5-(carboxymethylsulfanylmethyl)-2-methoxybenzoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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