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120-61-6

120-61-6 structural image
Product Name: Dimethyl terephthalate
Formula: C10H10O4
Synonyms: Dimethyl 1,4-benzenedicarboxylate, Terephthalic acid dimethyl ester, DMT;Dimethyl terephthalate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Dimethyl terephthalate appears as white solid or heated colorless liquid. Has no odor. Liquid solidifies in cool water. Solid and liquid sink in water. (USCG, 1999)
Color/Form Colorlesss crystals
Boiling Point 572 °F at 760 mmHg (sublimes) (NTP, 1992)
Melting Point 284 to 288 °F (NTP, 1992)
Flash Point 308 °F (NTP, 1992)
Solubility less than 1 mg/mL at 55 °F (NTP, 1992)
Density 1.2 at 68 °F 1.08 at 145 °C (liquid) (USCG, 1999) - Denser than water; will sink
Vapor Density 6.7 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure 16 mmHg at 212 °F ; 140 mmHg at 302 °F (NTP, 1992)
LogP log Kow = 2.25
Autoignition Temperature 1058 °F (USCG, 1999)
Decomposition When heated to decomposition it emits acrid smoke and irritating fumes.
Viscosity Liquid viscosity = 1.0682X10-3 Pa.s
Surface Tension 2.5332X10-2 N/m at melting point
Kovats Retention Index 1469 1461 1470 1480 1492 1475 1468 1512 1473 1468 1475 1475 1457.8 1517.6 1517.4
Other Experimental Properties Sublimes above 300 °C
Chemical Classes Other Classes -> Other Aromatic Compounds

COMPUTED DESCRIPTORS

Molecular Weight 194.18 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 194.05790880 g/mol
Monoisotopic Mass 194.05790880 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 192
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Dimethyl terephthalate appears as white solid or heated colorless liquid. Has no odor. Liquid solidifies in cool water. Solid and liquid sink in water. (USCG, 1999)

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