2-(3-chloro-4-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(3-chloro-4-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
2-(3-chloro-4-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | 3406-0102 |
Compound Name: | 2-(3-chloro-4-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione |
Molecular Weight: | 301.77 |
Molecular Formula: | C17 H16 Cl N O2 |
Smiles: | Cc1ccc(cc1[Cl])N1C(C2C3CCC(C=C3)C2C1=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.2241 |
logD: | 3.2241 |
logSw: | -3.4109 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 28.9926 |
InChI Key: | YYOKOHYQKWIPBT-UHFFFAOYSA-N |