3-(3-chlorophenyl)-2-cyanoprop-2-enoic acid
Chemical Structure Depiction of
3-(3-chlorophenyl)-2-cyanoprop-2-enoic acid
3-(3-chlorophenyl)-2-cyanoprop-2-enoic acid
Compound characteristics
Compound ID: | 8020-6734 |
Compound Name: | 3-(3-chlorophenyl)-2-cyanoprop-2-enoic acid |
Molecular Weight: | 207.61 |
Molecular Formula: | C10 H6 Cl N O2 |
Smiles: | C(=C(/C#N)C(O)=O)/c1cccc(c1)[Cl] |
Stereo: | ACHIRAL |
logP: | 1.9113 |
logD: | -5.1564 |
logSw: | -2.4984 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.703 |
InChI Key: | ZJPFPCNAMVQPCL-UHFFFAOYSA-N |