2-Propenoic acid, 2-(1,1-dimethylethyl)-6-[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methylphenyl ester
Product Information
Molecular Formula
C26H34O3
Molecular Weight
394.56
Description
2-Propenoic acid, 2-(1,1-dimethylethyl)-6-[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methylphenyl ester is a key chemical molecule against drug-resistant strains and has shown great potential in drug development for a variety of diseases.
Synonyms
2-tert-Butyl-6-(3-tert-butyl-2-hydroxy-5-methylbenzyl)-4-methylphenyl acrylate; Sumilizer GM; [2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl] prop-2-enoate; 2-(2-HYDROXY-3-TERT-BUTYL-5-METHYLBENZYL)-4-METHYL-6-TERT-BUTYLPHENYL ACRYLATE; 2-(1,1-dimethylethyl)-6-[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methylphenyl acrylate; 2-Propenoic acid, 2-(1,1-dimethylethyl)-6-((3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl)methyl)-4-methylphenyl ester; 2-Propenoic acid, 2-(1,1-dimethylethyl)-6-[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl]-4-methylphenyl ester
IUPAC Name
[2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl] prop-2-enoate
SMILES
CC1=CC(=C(C(=C1)C(C)(C)C)O)CC2=C(C(=CC(=C2)C)C(C)(C)C)OC(=O)C=C
InChI
InChI=1S/C26H34O3/c1-10-22(27)29-24-19(12-17(3)14-21(24)26(7,8)9)15-18-11-16(2)13-20(23(18)28)25(4,5)6/h10-14,28H,1,15H2,2-9H3
InChI Key
IORUEKDKNHHQAL-UHFFFAOYSA-N
Melting Point
136 °C
Purity
>96.0%(HPLC)
Appearance
White to Almost white powder to crystal
Storage
0-10°C
Computed Properties
XLogP3
7.9
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
7
Exact Mass
394.25079494 g/mol
Monoisotopic Mass
394.25079494 g/mol
Topological Polar Surface Area
46.5Ų
Heavy Atom Count
29
Formal Charge
0
Complexity
568
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
Patents
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|---|---|---|
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| CN-113308020-A | Water-based antioxidant emulsion and preparation method and application thereof | 2021-04-22 |
| JP-2021073134-A | Rubber composition for tires and tires | 2021-02-03 |
| CN-112795160-A | Antibacterial masterbatch for transparent polycarbonate and preparation method thereof | 2020-12-30 |
| CN-112029280-A | Halogen-free flame-retardant polyamide composite material and preparation method thereof | 2020-11-06 |
| CN-112029280-B | Halogen-free flame-retardant polyamide composite material and preparation method thereof | 2020-11-06 |
| WO-2022050103-A1 | Curable silicone gel composition and silicone gel cured product | 2020-09-03 |
| JP-2022041689-A | Thermoplastic resin, dihydroxy compound | 2020-09-01 |
| WO-2022039244-A1 | Compound, additive for synthetic resin, additive composition for synthetic resin, resin composition, and molded article of same | 2020-08-21 |
