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CAS No.: | 1026-92-2 |
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Name: | TEREPHTHALIC ACID DIALLYL ESTER |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C14H14O4 |
Molecular Weight: | 246.263 |
Synonyms: | 1,4-Benzenedicarboxylicacid, di-2-propenyl ester (9CI);Terephthalic acid, diallyl ester(6CI,7CI,8CI);DAPren Monomer;Diallyl terephthalate; |
EINECS: | 213-835-2 |
Density: | 1.112 g/cm3 |
Boiling Point: | 349.898 °C at 760 mmHg |
Flash Point: | 171.336 °C |
Transport Information: | 163447-36-7 |
PSA: | 52.60000 |
LogP: | 2.37220 |
Conditions | Yield |
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With potassium hydroxide; tetrabutylammomium bromide 1.) 60 deg C, 0.1 Torr, 6 h, 2.) 85 deg C, 60 h; Yield given. Multistep reaction; |
sodium tungstate (VI) dihydrate
diallyl terephthalate
Aliquat 336
terephthalic acid diglycidyl ester
Conditions | Yield |
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With phosphoric acid; dihydrogen peroxide In water; toluene | 85% |
diallyl terephthalate
Conditions | Yield |
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With tricyclohexylphosphine[1,3-bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidine][benzylidene]ruthenium(II) dichloride In dichloromethane at 45℃; for 22h; | 60% |
dimethylmonochlorosilane
diallyl terephthalate
Terephthalic acid 1-allyl ester 4-[3-(chloro-dimethyl-silanyl)-propyl] ester
Conditions | Yield |
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With dihydrogen hexachloroplatinate In isopropyl alcohol |
diallyl terephthalate
Terephthalic acid 1-allyl ester 4-[3-(methoxy-dimethyl-silanyl)-propyl] ester
Conditions | Yield |
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Multi-step reaction with 2 steps 1: H2PtCl6 / propan-2-ol 2: urea / benzene View Scheme |
Conditions | Yield |
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1,1,3,3-tetramethyl butyl-1-peroxy 2-ethylhexanoate at 50 - 90℃; for 24h; Product distribution / selectivity; |
Conditions | Yield |
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1,1,3,3-tetramethyl butyl-1-peroxy 2-ethylhexanoate at 50 - 90℃; for 24h; Product distribution / selectivity; |
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The 1,4-Benzenedicarboxylicacid, 1,4-di-2-propen-1-yl ester, with the CAS registry number 1026-92-2, is also known as Diallyl terephthalate. Its EINECS registry number is 213-835-2. This chemical's molecular formula is C14H14O4 and molecular weight is 246.26. What's more, its IUPAC name is called Bis(prop-2-enyl) benzene-1,4-dicarboxylate.
Physical properties about 1,4-Benzenedicarboxylicacid, 1,4-di-2-propen-1-yl ester are: (1)ACD/LogP: 3.907; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.91; (4)ACD/LogD (pH 7.4): 3.91; (5)ACD/BCF (pH 5.5): 548.90; (6)ACD/BCF (pH 7.4): 548.90; (7)ACD/KOC (pH 5.5): 3180.77; (8)ACD/KOC (pH 7.4): 3180.77; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 52.6 Å2; (13)Index of Refraction: 1.524; (14)Molar Refractivity: 67.781 cm3; (15)Molar Volume: 221.433 cm3; (16)Polarizability: 26.871×10-24cm3; (17)Surface Tension: 39.213 dyne/cm; (18)Density: 1.112 g/cm3; (19)Flash Point: 171.336 °C; (20)Enthalpy of Vaporization: 59.444 kJ/mol; (21)Boiling Point: 349.898 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OC\C=C)c1ccc(C(=O)OC\C=C)cc1
(2) InChI: InChI=1S/C14H14O4/c1-3-9-17-13(15)11-5-7-12(8-6-11)14(16)18-10-4-2/h3-8H,1-2,9-10H2
(3) InChIKey: ZDNFTNPFYCKVTB-UHFFFAOYSA-N