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Dibutyl Isophthalate
[CAS# 3126-90-7]

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Identification
Name Dibutyl Isophthalate
Synonyms Benzene-1,3-Dicarboxylic Acid Dibutyl Ester; Dibutyl Isophthalate; Nsc6348
Molecular Structure CAS#: 3126-90-7, Dibutyl Isophthalate
Molecular Formula C16H22O4
Molecular Weight 278.35
CAS Registry Number 3126-90-7
SMILES C1=C(C=CC=C1C(OCCCC)=O)C(OCCCC)=O
InChI 1S/C16H22O4/c1-3-5-10-19-15(17)13-8-7-9-14(12-13)16(18)20-11-6-4-2/h7-9,12H,3-6,10-11H2,1-2H3
InChIKey GOPWOUQJIMLDDM-UHFFFAOYSA-N
Properties
Density 1.053g/cm3 (Cal.)
Boiling point 341.828°C at 760 mmHg (Cal.)
Flash point 180.165°C (Cal.)
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