HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86584792Generated: October 26, 2026
Methyl 4-[(3-methylethylphenyl)amino]-5-methylthiothiophene-2-carboxylate
https://huagongshe.com/en/chemical/86584792
Identifiers & Physical Properties
| Molecular formula | C16H19NOS2 |
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| Average molar mass | 305.5 g/mol |
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| SMILES | CCc1c(C)cccc1Nc1cc(C(=S)OC)sc1C |
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| InChIKey | REBWOZWREMWZBQ-UHFFFAOYSA-N |
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| PubChem CID | 86584792 |
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Chemical & Physical Properties
| XLogP | 5.5 |
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| Topological polar surface area | 81.6 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 20 |
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| Formal charge | 0 |
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| Complexity | 336 |
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![Methyl 4-[(3-methylethylphenyl)amino]-5-methylthiothiophene-2-carboxylate molecular structure](/img/chemical/86584792.png)