4-Benzoyl 4'-methyldiphenyl sulfide
Product Information
Molecular Formula
C20H16OS
Molecular Weight
304.41
Description
4-Benzoyl 4'-methyldiphenyl sulfide is a medicinal small molecule with anti-inflammatory properties.
Synonyms
4-(4-Methylphenylthio)benzophenone; [4-[(4-METHYLPHENYL)THIO]PHENYL](PHENYL)METHANONE; 4-BENZOYL 4'-METHYLDIPHENYL SULFIDE; 4-BENZOYL-4'-METHYL DIPHENYL SULPHIDE; 4-(P-TOLYLTHIO)BENZOPHENONE; SYNCURE BMS; SPEEDCURE BMDS; [4-[(4-methylphenyl)thio]phenyl]phenyl-m
IUPAC Name
[4-(4-methylphenyl)sulfanylphenyl]-phenylmethanone
SMILES
CC1=CC=C(C=C1)SC2=CC=C(C=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C20H16OS/c1-15-7-11-18(12-8-15)22-19-13-9-17(10-14-19)20(21)16-5-3-2-4-6-16/h2-14H,1H3
InChI Key
DBHQYYNDKZDVTN-UHFFFAOYSA-N
Melting Point
83 °C
Purity
>98.0%(GC)
Density
1.2 g/cm3
Appearance
White to Light yellow to Light red powder to crystal
Application
A reagent for high performance polymer research.
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
5.9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
4
Exact Mass
304.09218630 g/mol
Monoisotopic Mass
304.09218630 g/mol
Topological Polar Surface Area
42.4Ų
Heavy Atom Count
22
Formal Charge
0
Complexity
345
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
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113736085-A | Photosensitive resin composition for photocuring 3D printing and preparation method and application thereof | 2021-09-29 |
| CN-113528000-A | Radiation curable two-part waterborne coating compositions and coated articles made therefrom | 2021-07-09 |
| CN-113388075-A | Composition for 3D printing, 3D printing method and device | 2021-06-11 |
| CN-113321925-A | Composition for 3D printing, preparation method thereof, 3D printing method and device | 2021-06-10 |
| CN-113292516-A | Multifunctional epoxy vegetable oil-based acrylate and preparation method and application thereof | 2021-05-28 |
| CN-113214692-A | High-refraction resin composition and preparation method thereof | 2021-05-21 |
| CN-113372744-A | High-refractive-index acrylic optical material and preparation method and application thereof | 2021-05-21 |
| CN-113214114-A | Reactive group-blocked diisocyanate for 3D object printing, composition, and method and apparatus for printing 3D object | 2021-05-13 |
| CN-112812265-A | Polyurethane acrylate oligomer, preparation method thereof, coating composition and application thereof | 2020-12-31 |
| CN-112831021-A | Polyurethane acrylate oligomer, preparation method thereof, coating composition and application thereof | 2020-12-31 |
