Dimethyl phthalate - CAS 131-11-3

Catalog:	BB007255
Product Name:	Dimethyl phthalate
CAS:	131-11-3
Synonyms:	1,2-Benzene-dicarboxylic acid dimethyl ester; 1,2-Benzenedicarboxylic Acid 1,2-Dimethyl Ester; Avolin; DMP; Dimethyl 1,2-Benzenedicarboxylate; Dimethyl o-Phthalate; Fermine; Mipax; NSC 15398; NTM; Palatinol M; Repeftal; Solvanom; Solvarone; Unimoll DM; DMP
Application:	DMP can be used to plasticize cellulose acetate which can be further used in the production of laminated safety glass for flight helmets and goggles. It can be used as a plasticizer that forms complexes with polyvinyl alcohol (PVA) and lithium salts for the development of solid polymer electrolyte (SPE) for solar cell (SC) s. It may also be used as a mixture of polymeric solvents which can be used in the preparation of polyvinylidene fluoride (PVDF).

Technical Data

Related CAS:	64441-70-9 (Deleted CAS) 1352054-35-3 (Deleted CAS)
IUPAC Name:	dimethyl benzene-1,2-dicarboxylate
Description:	Dimethyl phthalate is used as a solvent and plasticizer in film coatings in pharmaceutical applications and is also widely used as an insect repellent.
Molecular Weight:	194.18
Molecular Formula:	C10H10O4
Canonical SMILES:	COC(=O)C1=CC=CC=C1C(=O)OC
InChI:	InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3
InChI Key:	NIQCNGHVCWTJSM-UHFFFAOYSA-N
Boiling Point:	282.7±8.0°C at 760 mmHg
Melting Point:	2.0-5.5°C
Flash Point:	156 °C
Purity:	≥99%
Density:	1.19 g/mL at 25°C
Solubility:	Soluble in Chloroform (Slightly), Ethyl Acetate (Slightly)
Appearance:	Colorless Oily Matter
Storage:	Store at 2-8°C
Decomposition:	Hazardous decomposition products: toxic gases and vapors (such as carbon monoxide) may be released in a fire involving dimethylphthalate
MDL:	MFCD00008425
LogP:	1.25980
Quality Standard:	100
Refractive Index:	n20/D 1.515 (lit.)
Stability:	Stable. Combustible. Incompatible with strong oxidizing agents, strong acids, strong bases, nitrates. Sensitive to prolonged exposure to light.
Vapor Pressure:	1 mm Hg at 212.5 °F ; 5 mm Hg at 269.2° F; 10 mm Hg at 297.7° F (NTP, 1992);0.00 mmHg;3.08X10-3 mm Hg at 25 °C /from experimentally-derived coefficients/;Vapor pressure, Pa at 20 °C: 0.8;0.01 mmHg;0.01 mmHg

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PMID	Publication Date	Title	Journal
28571686	20170805	Agonistic and antagonistic effects of phthalates and their urinary metabolites on the steroid hormone receptors ERα, ERβ, and AR	Toxicology letters
27825933	20170201	Comparative toxicity, oxidative stress and endocrine disruption potential of plasticizers in JEG-3 human placental cells	Toxicology in vitro : an international journal published in association with BIBRA
26924002	20161001	Lethal and sublethal effects of phthalate diesters in Silurana tropicalis larvae	Environmental toxicology and chemistry
27432241	20160101	Cytochrome P450-inhibitory activity of parabens and phthalates used in consumer products	The Journal of toxicological sciences
26472102	20151201	Comparison of toxicogenomic responses to phthalate ester exposure in an organotypic testis co-culture model and responses observed in vivo	Reproductive toxicology (Elmsford, N.Y.)

Complexity:	200
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	194.05790880
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	194.05790880
Rotatable Bond Count:	4
Topological Polar Surface Area:	52.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6