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Thioxanthone 97%

CAT: 0286-T11996Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-T11996Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
492-22-8
Synonyms
9-Oxothioxanthene; Thioxanthen-9-one
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00005066
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

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

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