8-chloro-5-(4-fluorophenyl)-3,4,5,6-tetrahydro-2H-1,6-benzothiazocine
Modify Date: 2025-08-28 12:18:13
8-chloro-5-(4-fluorophenyl)-3,4,5,6-tetrahydro-2H-1,6-benzothiazocine structure
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Common Name | 8-chloro-5-(4-fluorophenyl)-3,4,5,6-tetrahydro-2H-1,6-benzothiazocine | ||
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| CAS Number | 87697-04-9 | Molecular Weight | 307.81300 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C16H15ClFNS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 8-chloro-5-(4-fluorophenyl)-3,4,5,6-tetrahydro-2H-1,6-benzothiazocine |
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| Synonym | More Synonyms |
| Molecular Formula | C16H15ClFNS |
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| Molecular Weight | 307.81300 |
| Exact Mass | 307.06000 |
| PSA | 37.33000 |
| LogP | 5.65620 |
| InChIKey | AIHYBHGZYQDUBP-UHFFFAOYSA-N |
| SMILES | Fc1ccc(C2CCCSc3ccc(Cl)cc3N2)cc1 |
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~66%
8-chloro-5-(4-f... CAS#:87697-04-9 |
| Literature: Press, Jeffery B.; Eudy, Nancy H. Journal of Organic Chemistry, 1984 , vol. 49, # 1 p. 116 - 122 |
| Precursor 1 | |
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| DownStream 0 | |
| 2H-1,6-Benzothiazocine,8-chloro-5-(4-fluorophenyl)-3,4,5,6-tetrahydro |