2-(3,4-Dimethoxystyryl)-4,6-bis(trichloromethyl)-1,3,5-triazine
Product Information
Molecular Formula
C15H11Cl6N3O2
Molecular Weight
477.98
Description
2-(3,4-Dimethoxystyryl)-4,6-bis(trichloromethyl)-1,3,5-triazine, inherently a biochemical compound, plays a pivotal role in the synthesis of avant-garde antiretroviral agents. Derivatives of this compound exhibited remarkable efficacy against both HIV-1 and HIV-2 strains, offering possible potential for HIV therapeutic research.
Synonyms
2-(3,4-Dimethoxystyryl)-4,6-bis(trichloromethyl)-1,3,5-triazine; 2,4-bis-(Trichloromethyl)-6-(3,4-dimethoxy) styryl-s-triazine
IUPAC Name
2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
SMILES
COC1=C(C=C(C=C1)C=CC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl)OC
InChI
InChI=1S/C15H11Cl6N3O2/c1-25-9-5-3-8(7-10(9)26-2)4-6-11-22-12(14(16,17)18)24-13(23-11)15(19,20)21/h3-7H,1-2H3
InChI Key
ZJRNXDIVAGHETA-UHFFFAOYSA-N
Boiling Point
532.147°C at 760 mmHg
Melting Point
190 °C
Purity
>98.0%(LC)(N)
Density
1.578g/cm3
Appearance
Light yellow to Yellow to Orange powder to crystal
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Computed Properties
XLogP3
5.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
4
Exact Mass
476.895293 g/mol
Monoisotopic Mass
474.898243 g/mol
Topological Polar Surface Area
57.1Ų
Heavy Atom Count
26
Formal Charge
0
Complexity
463
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
1
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114144709-A | Polarizing film and method for producing same | 2019-07-31 |
| US-2021032539-A1 | Container containing polymerizable liquid crystal composition liquid, and method for storing polymerizable liquid crystal composition liquid | 2019-07-30 |
| EP-3763801-A1 | Quantum dot-containing material, method of preparing the same, and optical member and appapratus including the quantum dot-containing material | 2019-07-12 |
| US-2021009893-A1 | Quantum dot-containing material, method of preparing the same, and optical member and apparatus including the quantum dot-containing material | 2019-07-12 |
| US-2020308325-A1 | Composition and method for forming insulating part | 2019-03-28 |
| US-2020292939-A1 | Photosensitive resin composition, photosensitive dry film, method of manufacturing photosensitive dry film, method of manufacturing patterned resist film, method of manufacturing substrate with template and method of manufacturing plated article | 2019-03-13 |
| EP-3702387-A1 | Photosensitive resin composition, and method for etching glass substrate | 2019-02-28 |
| WO-2020162007-A1 | Colored curable resin composition | 2019-02-08 |
| WO-2020162008-A1 | Colored curable resin composition | 2019-02-08 |
| WO-2020162009-A1 | Colored curable resin composition | 2019-02-08 |
