propylparabenum Report issue

Small molecule Experimental
ChEMBL Drug Central MeSH PubChem

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Chemistry

Mol. Mass

202.1823

ALogP

1.96

Rule of 5

Yes

Rule of 3

Yes
Details
  • SMILES: [Na+].CCCOC(=O)C1=CC=C([O-])C=C1
  • InChIKey: IXMINYBUNCWGER-UHFFFAOYSA-M
    1S/C10H12O3.Na/c1-2-7-13-10(12)8-3-5-9(11)6-4-8;/h3-6,11H,2,7H2,1H3;/q;+1/p-1
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL194014   ChEMBL
propylparaben

625NNB0G9N   NCATS
propylparaben sodium *

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