6-(4-bromophenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile
Modify Date: 2025-09-12 22:18:12
6-(4-bromophenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile structure
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Common Name | 6-(4-bromophenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile | ||
|---|---|---|---|---|
| CAS Number | 61380-87-8 | Molecular Weight | 322.17700 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C13H8BrNO2S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 6-(4-bromophenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile |
|---|
| Molecular Formula | C13H8BrNO2S |
|---|---|
| Molecular Weight | 322.17700 |
| Exact Mass | 320.94600 |
| PSA | 79.30000 |
| LogP | 3.66288 |
| InChIKey | QLIZWGWIQMJGMB-UHFFFAOYSA-N |
| SMILES | CSc1cc(-c2ccc(Br)cc2)oc(=O)c1C#N |
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~41%
6-(4-bromopheny... CAS#:61380-87-8 |
| Literature: Mizuyama, Naoko; Murakami, Yuka; Kohra, Shinya; Ueda, Kazuo; Hiraoka, Kyoko; Nagaoka, Junko; Takahashi, Kojiro; Shigemitsu, Yasuhiro; Tominaga, Yoshinori Journal of Heterocyclic Chemistry, 2007 , vol. 44, # 1 p. 115 - 132 |
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~%
6-(4-bromopheny... CAS#:61380-87-8 |
| Literature: Ram, Vishnu J.; Goel, Atul; Shukla; Kapil Bioorganic and Medicinal Chemistry Letters, 1997 , vol. 7, # 24 p. 3101 - 3106 |
|
~35%
6-(4-bromopheny... CAS#:61380-87-8 |
| Literature: Tominaga, Yoshinori; Kawabe, Masanori; Hosomi, Akira Journal of Heterocyclic Chemistry, 1987 , vol. 24, p. 1325 - 1331 |
![2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE structure](https://image.chemsrc.com/caspic/249/5147-80-8.png)
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Source: ChEMBL
Target: Rattus norvegicus
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Source: ChEMBL
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Source: ChEMBL
Target: Rattus norvegicus
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