Diisoheptyl phthalate

Diisoheptyl phthalate is a phthalate used as a plasticizer.^[2] Diisoheptyl phthalate is typically a mixture of chemical compounds consisting of various isoheptyl esters of phthalic acid with the chemical formula C₂₂H₃₄O₄.

Diisoheptyl phthalate^[1]

Names
Preferred IUPAC name Bis(5-methylhexyl) benzene-1,2-dicarboxylate
Other names Bis(5-methylhexyl) phthalate 1,2-Benzenedicarboxylic acid bis(isoheptyl) ester
Identifiers
CAS Number	41451-28-9 Y
3D model (JSmol)	Interactive image
ChEMBL	ChEMBL1893293
ChemSpider	513939 Y
ECHA InfoCard	100.292.455
EC Number	276-158-1
PubChem CID	591200
UNII	9JJP9B98FG Y
CompTox Dashboard (EPA)	DTXSID30872297 DTXSID70872296, DTXSID30872297
InChI InChI=1S/C22H34O4/c1-17(2)11-7-9-15-25-21(23)19-13-5-6-14-20(19)22(24)26-16-10-8-12-18(3)4/h5-6,13-14,17-18H,7-12,15-16H2,1-4H3 N Key: RKELNIPLHQEBJO-UHFFFAOYSA-N N
SMILES O=C(OCCCCC(C)C)C1=CC=CC=C1C(OCCCCC(C)C)=O
Properties
Chemical formula	C22H34O4
Molar mass	362.510 g·mol−1
Density	0.99 g/cm3
Hazards
GHS labelling:
Pictograms
Signal word	Warning
Hazard statements	H360D
Precautionary statements	P201, P202, P281, P308+P313, P405, P501
Flash point	113 °C (235 °F; 386 K)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). N verify (what is YN ?) Infobox references

See also

• Diisononyl phthalate