dimethyl phthalate

Synonyms: "Dimethylphthalate", "Fermine", "Solvanom", "Avolin", "Solvarone", "Phthalic acid dimethyl ester", "Mipax", "Palatinol M", "Unimoll DM", "Repeftal", "Dimethyl o-phthalate", "Methyl phthalate", "dimethyl benzene-o-dicarboxylate", "dimethyl 1,2-benzenedicarboxylate", "dimethyl benzene-1,2-dicarboxylate", "DMF", "Dimethyl benzeneorthodicarboxylate", "dimethyl-phthalate".

Source: Dimethyl phthalate is a plasticizer widely found in the environment.

Identifiers:

IUPAC Name: dimethyl benzene-1,2-dicarboxylate
CAS Number: 131-11-3
PubChem ID: 8554
InChiKey: NIQCNGHVCWTJSM-UHFFFAOYSA-N
Canonical SMILES: COC(=O)C1=CC=CC=C1C(=O)OC

Structural Properties:

Molecular Formula: C₁₀H₁₀O₄
Molecular Weight: 194.186

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 4
Number of atoms different from hydrogen: 14

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Christen V, Crettaz P, Oberli-Schrammli A, Fent K. Some flame retardants and the antimicrobials triclosan and triclocarban enhance the androgenic activity in vitro. Chemosphere. 2010 Nov 30,81(10):1245-52. DOI: 10.1016/j.chemosphere.2010.09.031. URL: https://www.sciencedirect.com/science/article/pii/S0045653510010465.
Parez-Albaladejo E, Fernandes D, Lacorte S, Porte C. Comparative toxicity, oxidative stress and endocrine disruption potential of plasticizers in JEG-3 human placental cells. Toxicology in Vitro. 2017 Feb 28,38:41-8. DOI: 10.1016/j.tiv.2016.11.003. URL: https://www.sciencedirect.com/science/article/pii/S0887233316302259?via%3Dihub.