CAS No.1026-92-2,TEREPHTHALIC ACID DIALLYL ESTER Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1026-92-2
Name:	TEREPHTHALIC ACID DIALLYL ESTER
Article Data:	8

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

Synthetic route

: 107-18-6
allyl alcohol

: 100-20-9
terephthaloyl chloride

: 1026-92-2
diallyl terephthalate

: 100-21-0
terephthalic acid

: 106-95-6
allyl bromide

: 1026-92-2
diallyl terephthalate

Conditions

Conditions	Yield
With potassium hydroxide; tetrabutylammomium bromide 1.) 60 deg C, 0.1 Torr, 6 h, 2.) 85 deg C, 60 h; Yield given. Multistep reaction;

: 120-61-6
1,4-benzenedicarboxylic acid dimethyl ester

: 1026-92-2
diallyl terephthalate

: 10213-10-2
sodium tungstate (VI) dihydrate

: 1026-92-2
diallyl terephthalate

: 5137-55-3
Aliquat 336

: 7195-44-0
terephthalic acid diglycidyl ester

Conditions

Conditions	Yield
With phosphoric acid; dihydrogen peroxide In water; toluene	85%

...Expand

: 1026-92-2
diallyl terephthalate

: C36H30O12

Conditions

Conditions	Yield
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%

: 1066-35-9
dimethylmonochlorosilane

: 1026-92-2
diallyl terephthalate

: 20083-45-8
Terephthalic acid 1-allyl ester 4-[3-(chloro-dimethyl-silanyl)-propyl] ester

Conditions

Conditions	Yield
With dihydrogen hexachloroplatinate In isopropyl alcohol

: 1026-92-2
diallyl terephthalate

: 20083-48-1
Terephthalic acid 1-allyl ester 4-[3-(methoxy-dimethyl-silanyl)-propyl] ester

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: H2PtCl6 / propan-2-ol 2: urea / benzene View Scheme

Reaxys ID: 12665026: Reaxys ID: 12665026

: 622-06-0
dibenzyl maleate

: 769-78-8
vinyl benzoate

: 1026-92-2
diallyl terephthalate

Reaxys ID: 12664759: Reaxys ID: 12664759

Conditions

Conditions	Yield
1,1,3,3-tetramethyl butyl-1-peroxy 2-ethylhexanoate at 50 - 90℃; for 24h; Product distribution / selectivity;

...Expand

Reaxys ID: 12665026: Reaxys ID: 12665026

: 769-78-8
vinyl benzoate

: 1026-92-2
diallyl terephthalate

Reaxys ID: 12664754: Reaxys ID: 12664754

Conditions

Conditions	Yield
1,1,3,3-tetramethyl butyl-1-peroxy 2-ethylhexanoate at 50 - 90℃; for 24h; Product distribution / selectivity;

...Expand

: 1026-92-2
diallyl terephthalate

: 871-33-0
diethyltin dihydride

: {C6H4COO(CH2)3Sn(C2H5)2(CH2)3OCO}

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Specification

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