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Substrate Report for: Dibutyl-phthalate

Name Class
Dibutyl-phthalateTypeAryl ester
Phthalate
Other_Name (7)
Chemical_Nomenclaturedibutyl benzene-1,2-dicarboxylate
FormulaC16H22O4
CAS_number84-74-2
MW278.34
Paper (18)
CommentDibutyl phthalate is a plasticizer used in most plastics and found in water, air, soil, plants and animals. It may have some adverse effects with long-term exposure.
Gene_locus (9)
CID3026
Family (7)
InChIKeyDOIRQSBPFJWKBE-UHFFFAOYSA-N
CanonicalSMILESCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC
InChIInChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3

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Please cite: Lenfant 2013 Nucleic.Acids.Res. or Marchot Chatonnet 2012 Prot.Pept Lett.
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