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P-Tolyl sulfone 97%

CAT: 0286-T16785-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-T16785-01Size:5 g
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CAS Number
599-66-6
Synonyms
Di-p-tolyl sulfone; bis (4-Methylphenyl) sulfone; 1-Methyl-4-[ (4-methylbenzene) sulfonyl]benzene
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00041332
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

Benzene, 1,1'-sulfonylbis(4-methyl-
CAS Number599-66-6
PubChem CID69030
IUPAC Name1-methyl-4-(4-methylphenyl)sulfonylbenzene
Molecular FormulaC14H14O2S
Molecular Weight246.33
XLogP3.4
Topological Polar Surface Area42.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity298
SMILES
CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C
InChI
InChI=1S/C14H14O2S/c1-11-3-7-13(8-4-11)17(15,16)14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChIKey
WEAYCYAIVOIUMG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzene, 1,1'-sulfonylbis(4-methyl-
CAS: 599-66-6
CID: 69030
Formula: C14H14O2S
MW: 246.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight246.33
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass246.07145086
Monoisotopic Mass246.07145086
Topological Polar Surface Area42.5 Ų
Heavy Atom Count17
Formal Charge0
Complexity298
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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Alternative Products

CatalogName
283336-01Methylthiomethyl p-tolyl sulfone
275991-01Ethynyl p-Tolyl Sulfone
sc-234532Di-p-tolyl sulfone
sc-279971Phenyl p-tolyl sulfone
AR-T05629-01Ethyl p-Tolyl Sulfone
sc-2656352-Chloroethyl p-tolyl sulfone
90028450Tolyl diiodomethyl sulfone
TRC-M400200-500MGp-Methyldiphenyl Sulfone
AAA33925P-Fluorophenyl-p-methoxyphenyl sulfone
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