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Thioxanthone

CAT: 0804-HY-W039724-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0804-HY-W039724-01Size:25 g
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Description
Thioxanthone is a powerful photocatalyst for organic reactions. Thioxanthone is a heterocyclic compound with the ability to participate successfully in merger reactions with metal complexes[1].
CAS Number
492-22-8
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Purity
99.37
Solubility
DMSO : 4 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
O=C1C2=C(SC3=C1C=CC=C3)C=CC=C2
Molecular Formula
C13H8OS
Molecular Weight
212.27
Precautions
H302, H315, H319, H335
References & Citations
[1]Nikitas NF, et al. Thioxanthone: a powerful photocatalyst for organic reactions. Org Biomol Chem. 2021 Jun 28;19 (24) :5237-5253.
Shipping Conditions
Room Temperature
Storage Conditions
Store at room temperature 3 years
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Thioxanthone

structure in first source

CAS Number492-22-8
PubChem CID10295
IUPAC Namethioxanthen-9-one
Molecular FormulaC13H8OS
Molecular Weight212.27
XLogP4
Topological Polar Surface Area42.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity239
SMILES
C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3S2
InChI
InChI=1S/C13H8OS/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H
InChIKey
YRHRIQCWCFGUEQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Thioxanthone
CAS: 492-22-8
CID: 10295
Formula: C13H8OS
MW: 212.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight212.27
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass212.02958605
Monoisotopic Mass212.02958605
Topological Polar Surface Area42.4 Ų
Heavy Atom Count15
Formal Charge0
Complexity239
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
PDK0236Thioxanthone
FT02852-019-Thioxanthone
T11996Thioxanthone 97%
T7957-012-Isopropyl Thioxanthone
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289853-01Thioxanthone carboxylic acid
JH2541012-hydroxy thioxanthone
FC30928-012- (Carboxymethoxy) -thioxanthone
sc-4914172-Isopropyl-d7 thioxanthone
I108952-Isopropyl thioxanthone 97%

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