S-benzyl propanethioate
S-benzyl propanethioate structure
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Common Name | S-benzyl propanethioate | ||
|---|---|---|---|---|
| CAS Number | 22786-75-0 | Molecular Weight | 180.26700 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C10H12OS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | S-benzyl propanethioate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C10H12OS |
|---|---|
| Molecular Weight | 180.26700 |
| Exact Mass | 180.06100 |
| PSA | 42.37000 |
| LogP | 2.85640 |
| InChIKey | HVQYODLLQPXQEB-UHFFFAOYSA-N |
| SMILES | CCC(=O)SCc1ccccc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~60%
S-benzyl propan... CAS#:22786-75-0 |
| Literature: Chen, Rener; Zhang, Yongmin Synthetic Communications, 1999 , vol. 29, # 21 p. 3699 - 3704 |
|
~%
S-benzyl propan... CAS#:22786-75-0 |
| Literature: Piepers, Oscar; Kellogg, Richard M. Journal of the Chemical Society, Chemical Communications, 1980 , # 23 p. 1147 - 1149 |
|
~%
S-benzyl propan... CAS#:22786-75-0 |
| Literature: Morgenstern,J.; Mayer,R. Zeitschrift fuer Chemie (Stuttgart, Germany), 1969 , vol. 9, p. 182 - 183 |
|
~%
S-benzyl propan... CAS#:22786-75-0 |
| Literature: Gorski,R.A. et al. Tetrahedron Letters, 1976 , p. 2577 - 2580 |
|
~%
S-benzyl propan... CAS#:22786-75-0 |
| Literature: Piepers, Oscar; Kellogg, Richard M. Journal of the Chemical Society, Chemical Communications, 1980 , # 23 p. 1147 - 1149 |
![1-methyl-3,5-bis[(ethylamino)carbonyl]-4-(benzylthio)-1,4-dihydropyridine structure](https://image.chemsrc.com/caspic/319/76942-34-2.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 1 | |
CAS#:122-74-7This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| propanethioic acid S-benzyl ester |
| S-Benzylthiopropanoic acid |
| Thiopropionsaeure-S-benzylester |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of S-benzyl propanethioate? |
| A: SMILES notation of S-benzyl propanethioate is CCC(=O)SCc1ccccc1. |
| Q: What English synonyms does S-benzyl propanethioate have? |
| A: English synonyms of S-benzyl propanethioate: propanethioic acid S-benzyl ester, S-Benzylthiopropanoic acid, Thiopropionsaeure-S-benzylester. |
| Q: What are the downstream products of S-benzyl propanethioate? |
| A: Related downstream products(CAS) of S-benzyl propanethioate: 122-74-7. |
| Q: What is the Chinese name of 22786-75-0? |
| A: Chinese name of 22786-75-0 is 22786-75-0. |
| Q: What is the molecular formula of S-benzyl propanethioate? |
| A: Molecular formula of S-benzyl propanethioate is C10H12OS. |
| Q: What is the LogP of S-benzyl propanethioate? |
| A: LogP of S-benzyl propanethioate is 2.85640. |
| Q: What are the upstream materials of S-benzyl propanethioate? |
| A: Related upstream materials(CAS) of S-benzyl propanethioate: 150-60-7;123-62-6;100-53-8;71-23-8;32362-99-5;74-88-4;76942-34-2. |
| Q: What is the molecular weight of S-benzyl propanethioate? |
| A: Molecular weight of S-benzyl propanethioate is 180.26700. |
| Q: What is the polar surface area (PSA) of S-benzyl propanethioate? |
| A: Polar surface area (PSA) of S-benzyl propanethioate is 42.37000. |
| Q: What is the CAS number of S-benzyl propanethioate? |
| A: CAS number of S-benzyl propanethioate is 22786-75-0. |