Mono-(2-ethylhexyl) phthalate Next Previous

ChEMBL ID CHEMBL1867438
PubChem CID 20393
DrugBank Accession Number
ClinicalTrials Mono-(2-ethylhexyl) phthalate
Molecular Formula C16H22O4
Inchikey DJDSLBVSSOQSLW-UHFFFAOYSA-N
Cas Number 4376-20-9

Smiles
CCCCC(CC)COC(=O)c1ccccc1C(=O)O

Compound Properties
Drug/Drug-like Properties
Known Drug
Medchem Alerts None
Passes of Rule of 3
Rule of 5 Violations 0
Molecular Species ACID
Molecular Properties
Molecular Weight 278.35
Rotatable Bonds 8
Acidic pKa (ACD) -
Basic pKa (ACD) -
LogP (ACD) -
LogD (ACD) -
ALogP 3.76
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