5,5-dimethyl-3-{2-[4-(1H-triazirin-1-yl)phenyl]ethenyl}cyclohex-2-en-1-one
					Chemical Structure Depiction of
5,5-dimethyl-3-{2-[4-(1H-triazirin-1-yl)phenyl]ethenyl}cyclohex-2-en-1-one
			5,5-dimethyl-3-{2-[4-(1H-triazirin-1-yl)phenyl]ethenyl}cyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 0103-0024 | 
| Compound Name: | 5,5-dimethyl-3-{2-[4-(1H-triazirin-1-yl)phenyl]ethenyl}cyclohex-2-en-1-one | 
| Molecular Weight: | 267.33 | 
| Molecular Formula: | C16 H17 N3 O | 
| Smiles: | CC1(C)CC(/C=C/c2ccc(cc2)N2N=N2)=CC(C1)=O | 
| Stereo: | ACHIRAL | 
| logP: | 3.1414 | 
| logD: | 3.1414 | 
| logSw: | -3.1535 | 
| Hydrogen bond acceptors count: | 4 | 
| Polar surface area: | 38.773 | 
| InChI Key: | DTEMMFZSXNLHHE-UHFFFAOYSA-N | 
 
				 
				