2-{[2-(Diethylamino)-2-oxoethyl]sulfanyl}benzoic acid
2-[2-(diethylamino)-2-oxoethyl]sulfanylbenzoic acid
Also Known As: Oprea1_611101|2-(diethylcarbamoylmethylsulfanyl)benzoic Acid|2-[(N,N-diethylcarbamoyl)methylthio]benzoic acid|2-{[2-(diethylamino)-2-oxoethyl]sulfanyl}benzoic acid|2-[2-(diethylamino)-2-oxoethyl]sulfanylbenzoic acid|2-{[2-(DIETHYLAMINO)-2-OXOETHYL]THIO}BENZOIC ACID
CAS: 355809-21-1
| Molecular Formula | C13H17NO3S |
|---|---|
| Molecular Weight | 267.09293 g/mol |
| LogP | 2.3453 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 267.09293 |
| Monoisotopic Mass | 267.09293 |
| Heavy Atoms | 18 |
| Complexity | 429.99945 |
Chemical Identifiers
| CAS Number | 355809-21-1 |
|---|---|
| SMILES | CCN(CC)C(=O)CSC1=CC=CC=C1C(=O)O |
Product Overview
2-{[2-(Diethylamino)-2-oxoethyl]sulfanyl}benzoic acid (CAS 355809-21-1), with molecular formula C13H17NO3S and molecular weight 267.09293 g/mol. IUPAC: 2-[2-(diethylamino)-2-oxoethyl]sulfanylbenzoic 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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2-{[2-(Diethylamino)-2-oxoethyl]sulfanyl}benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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