4-Heptyl-thiobenzoic acid S-(4-cyano-phenyl) ester
Modify Date: 2025-09-20 06:57:41
4-Heptyl-thiobenzoic acid S-(4-cyano-phenyl) ester structure
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Common Name | 4-Heptyl-thiobenzoic acid S-(4-cyano-phenyl) ester | ||
|---|---|---|---|---|
| CAS Number | 64408-99-7 | Molecular Weight | 337.47800 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C21H23NOS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 4-Heptyl-thiobenzoic acid S-(4-cyano-phenyl) ester |
|---|
| Molecular Formula | C21H23NOS |
|---|---|
| Molecular Weight | 337.47800 |
| Exact Mass | 337.15000 |
| PSA | 66.16000 |
| LogP | 6.00368 |
| InChIKey | SEDZRFGIMHTHDW-UHFFFAOYSA-N |
| SMILES | CCCCCCCc1ccc(C(=O)Sc2ccc(C#N)cc2)cc1 |