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| IUPAC Name: | tert-butyl N-(4-oxocyclohexyl)carbamate |
| Description: | N-4-Boc-aminocyclohexanone (CAS# 179321-49-4) is an intermediate in the synthesis of tert-Butyl 1,7-diazaspiro[3.5]nonane-1-carboxylate (B692795). tert-Butyl 1,7-diazaspiro[3.5]nonane-1-carboxylate is a reagent in the preparation of -[4-fluoro-3-(piperazin-1-ylcarbonyl)benzyl]-4,5-dimethylpyridazin-3(2H)-ones as a potent poly(ADP-ribose) polymerase-1 inhibitors active in BRCA deficient cells. |
| Molecular Weight: | 213.27 |
| Molecular Formula: | C11H19NO3 |
| Canonical SMILES: | CC(C)(C)OC(=O)NC1CCC(=O)CC1 |
| InChI: | InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)12-8-4-6-9(13)7-5-8/h8H,4-7H2,1-3H3,(H,12,14) |
| InChI Key: | WYVFPGFWUKBXPZ-UHFFFAOYSA-N |
| Boiling Point: | 335.9 ℃ at 760 mmHg |
| Density: | 1.06 g/cm3 |
| MDL: | MFCD00798168 |
| LogP: | 2.41370 |
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