1,4-Benzenedicarboxylicacid, 2-fluoro-, 1,4-dimethyl ester supplier

Name
DIMETHYL 2-FLUOROTEREPHTHALATE
EINECS 226-135-7
CAS No. 5292-47-7
Article Data3
CAS DataBase
Density 1.252g/cm³
Solubility
Melting Point 83-85 °C(lit.)
Formula C₁₀H₉FO₄
Boiling Point 299.4 °C at 760 mmHg
Molecular Weight 212.177
Flash Point 130.6 °C
Transport Information
Appearance white to light yellow crystal powder
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 1,4-Benzenedicarboxylicacid, 2-fluoro-, dimethyl ester (9CI);Terephthalic acid, fluoro-, dimethyl ester(7CI,8CI);Dimethyl 2-fluoroterephthalate;
PSA 52.60000
LogP 1.39890

1,4-Benzenedicarboxylicacid, 2-fluoro-, 1,4-dimethyl ester Specification

The 1,4-Benzenedicarboxylicacid, 2-fluoro-, 1,4-dimethyl ester, with CAS registry number 5292-47-7, belongs to the following product categories: (1)Benzoic acid; (2)Miscellaneous; (3)C10 to C11; (4)Carbonyl Compounds; (5)Esters. It has the systematic name of dimethyl 2-fluorobenzene-1,4-dicarboxylate. This chemical is a kind of white to light yellow crystal powder. What's more, its EINECS is 226-135-7.

Physical properties of 1,4-Benzenedicarboxylicacid, 2-fluoro-, 1,4-dimethyl ester: (1)ACD/LogP: 2.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.43; (4)ACD/LogD (pH 7.4): 2.43; (5)ACD/BCF (pH 5.5): 41.12; (6)ACD/BCF (pH 7.4): 41.12; (7)ACD/KOC (pH 5.5): 497.65; (8)ACD/KOC (pH 7.4): 497.65; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 52.6 Å²; (13)Index of Refraction: 1.499; (14)Molar Refractivity: 49.79 cm³; (15)Molar Volume: 169.4 cm³; (16)Polarizability: 19.73×10^-24cm³; (17)Surface Tension: 39.2 dyne/cm; (18)Density: 1.252 g/cm³; (19)Flash Point: 130.6 °C; (20)Enthalpy of Vaporization: 53.94 kJ/mol; (21)Boiling Point: 299.4 °C at 760 mmHg; (22)Vapour Pressure: 0.00119 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)c1ccc(cc1F)C(=O)OC
(2)InChI: InChI=1/C10H9FO4/c1-14-9(12)6-3-4-7(8(11)5-6)10(13)15-2/h3-5H,1-2H3
(3)InChIKey: NCRFSIQSCLJDIC-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C10H9FO4/c1-14-9(12)6-3-4-7(8(11)5-6)10(13)15-2/h3-5H,1-2H3
(5)Std. InChIKey: NCRFSIQSCLJDIC-UHFFFAOYSA-N

Product Name

DIMETHYL 2-FLUOROTEREPHTHALATE

1,4-Benzenedicarboxylicacid, 2-fluoro-, 1,4-dimethyl ester Specification

Related Products

Hot Products