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85-71-2

Basic Information
CAS No.: 85-71-2
Name: METHYLPHTHALYL ETHYL GLYCOLATE
Molecular Structure:
Molecular Structure of 85-71-2 (METHYLPHTHALYL ETHYL GLYCOLATE)
Formula: C13H14 O6
Molecular Weight: 266.251
Synonyms: 1,2-Benzenedicarboxylicacid, 2-ethoxy-2-oxoethyl methyl ester (9CI); Phthalic acid, methyl ester,ester with ethyl glycolate (6CI,7CI,8CI); Glycolic acid, ethyl ester, methylphthalate (8CI); Ethoxycarbonylmethyl methyl phthalate; EthylO-[o-(methoxycarbonyl)benzoyl]glycolate; Methyl carbethoxymethyl phthalate;Methyl phthalyl ethyl glycolate; NSC 4836; Santicizer M-17
Density: 1.22g/cm3
Melting Point: -35°C
Boiling Point: 360.1°C at 760 mmHg
Flash Point: 158°C
Solubility: 529.7mg/L(20 oC)
Safety: An eye irritant. Combustible when exposed to heat or flame; can react with oxidizing materials. To fight fire, use CO2, dry chemical. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.
PSA: 78.90000
LogP: 1.19310
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  • 1,2-Benzenedicarboxylicacid, 1-(2-ethoxy-2-oxoethyl) 2-methyl ester

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  • 1-O-(3,4-dihydroxybutyl) 2-O-methyl benzene-1,2-dicarboxylate

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    1-O-(3,4-dihydroxybutyl) 2-O-methyl benzene-1,2-dicarboxylate

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    We are committed to providing our customers with the best products and services at the most competitive prices.Appearance:light yellow liquid Storage:Room temperature with sealed well Package:according to the clients requirement Application:Use as pr

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  • 1,2-Benzenedicarboxylicacid, 1-(2-ethoxy-2-oxoethyl) 2-methyl ester cas  85-71-2

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    1,2-Benzenedicarboxylicacid, 1-(2-ethoxy-2-oxoethyl) 2-methyl ester cas 85-71-2Appearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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  • METHYLPHTHALYL ETHYL GLYCOLATE

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    METHYLPHTHALYL ETHYL GLYCOLATE

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    factory?direct?saleAppearance:White powder Storage:Sealed and preserved Package:200/Kilograms Application:healing drugs Transportation:By sea Port:Shanghai/tianjin

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Chemistry

Molecule structure of Methyl phthalyl ethyl glycolate (CAS NO.85-71-2) :

IUPAC Name: 1-O-(3,4-dihydroxybutyl) 2-O-methyl benzene-1,2-dicarboxylate 
Molecular Weight: 268.26254 g/mol
Molecular Formula: C13H16O6 
Density: 1.22 g/cm3 
Boiling Point: 360.1 °C at 760 mmHg 
Flash Point: 158 °C
Index of Refraction: 1.511
Molar Refractivity: 65.47 cm3
Molar Volume: 218.2 cm3
Polarizability: 25.95×10-24 cm3
Surface Tension: 43.6 dyne/cm 
Enthalpy of Vaporization: 60.58 kJ/mol
Vapour Pressure: 2.27E-05 mmHg at 25 °C 
XLogP3: 0.6
H-Bond Donor: 2
H-Bond Acceptor: 6
Rotatable Bond Count: 8
Exact Mass: 268.094688
MonoIsotopic Mass: 268.094688
Topological Polar Surface Area: 93.1
Heavy Atom Count: 19
Complexity: 304
Canonical SMILES: COC(=O)C1=CC=CC=C1C(=O)OCCC(CO)O
InChI: InChI=1S/C13H16O6/c1-18-12(16)10-4-2-3-5-11(10)13(17)19-7-6-9(15)8-14/h2-5,9,14-15H,6-8H2,1H3
InChIKey: YJERZJLSXBRUDQ-UHFFFAOYSA-N
EINECSof Methyl phthalyl ethyl glycolate (CAS NO.85-71-2) : 201-625-3

Toxicity Data With Reference

1.    

eye-rbt 500 mg

    AJOPAA    American Journal of Ophthalmology. 29 (1946),1363.

Safety Profile

An eye irritant. Combustible when exposed to heat or flame; can react with oxidizing materials. To fight fire, use CO2, dry chemical. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.

Specification

 Methyl phthalyl ethyl glycolate (CAS NO.85-71-2) is also called (Ethoxycarbonyl)methyl phthalate ; 4-09-00-03256 (Beilstein Handbook Reference) ; AI3-01792 ; BRN 1995396 ; Ethoxycarbonylmethyl methyl phthalate ; Ethoxykarbonylmethyl-methylester kyseliny ftalove ; Ethyl O-(o-(methoxycarbonyl)benzoyl)glycolate ; Ethyl o-(methoxycarbonyl)benzoyloxyacetate ; Ethyl o-(o-(methoxycarbonyl)benzoyl)glycolate ; Glycolic acid, ethyl ester, methyl phthalate ; Methyl carbethoxymethyl phthalate ; NSC 4836 ; Phthalic acid, monomethyl ester, ester with ethyl glycolate ; Santicizer M-17 .