5-(3-chlorophenyl)cyclohexane-1,3-dione

Chemical Structure Depiction of
5-(3-chlorophenyl)cyclohexane-1,3-dione
Available: 189 mg
Amount:
mg
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Compound characteristics

Compound ID: R052-3840
Compound Name: 5-(3-chlorophenyl)cyclohexane-1,3-dione
Molecular Weight: 222.67
Molecular Formula: C12 H11 Cl O2
Smiles: C1C(CC(CC1=O)=O)c1cccc(c1)[Cl]
Stereo: ACHIRAL
logP: 2.3438
logD: -1.7166
logSw: -2.7977
Hydrogen bond acceptors count: 4
Polar surface area: 26.8577
InChI Key: YSNSALYPQQBIDC-UHFFFAOYSA-N
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