(1-acetyl-4-methylcyclohex-3-en-1-yl) 4-nitrobenzoate
Modify Date: 2025-09-16 12:56:17
(1-acetyl-4-methylcyclohex-3-en-1-yl) 4-nitrobenzoate structure
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Common Name | (1-acetyl-4-methylcyclohex-3-en-1-yl) 4-nitrobenzoate | ||
|---|---|---|---|---|
| CAS Number | 111945-64-3 | Molecular Weight | 303.31000 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C16H17NO5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | (1-acetyl-4-methylcyclohex-3-en-1-yl) 4-nitrobenzoate |
|---|---|
| Synonym | More Synonyms |
| Molecular Formula | C16H17NO5 |
|---|---|
| Molecular Weight | 303.31000 |
| Exact Mass | 303.11100 |
| PSA | 89.19000 |
| LogP | 3.73280 |
| InChIKey | RTORHTVLHUZKHB-UHFFFAOYSA-N |
| SMILES | CC(=O)C1(OC(=O)c2ccc([N+](=O)[O-])cc2)CC=C(C)CC1 |
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~92%
(1-acetyl-4-met... CAS#:111945-64-3 |
| Literature: Orduna; Zepeda; Tamariz Synthesis, 1993 , # 4 p. 375 - 377 |
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~85%
(1-acetyl-4-met... CAS#:111945-64-3 |
| Literature: Reyes, Alicia; Aguilar, Raul; Munoz, Alfredo H.; Zwick, Jean-Christophe; Rubio, Manuel; et al. Journal of Organic Chemistry, 1990 , vol. 55, # 3 p. 1024 - 1034 |
| Precursor 2 | |
|---|---|
| DownStream 1 | |
CAS#:122-00-9| 1-Acetyl-4-methyl-3-cyclohexen-1-yl p-nitrobenzoate |
| Ethanone,1-[4-methyl-1-[(4-nitrobenzoyl)oxy]-3-cyclohexen-1-yl] |
| 1-Acetyl-4-methyl-3-cyclohexenyl p-Nitrobenzoate |