p-Toluenesulfonic Acid Methyl Ester - Materials / Alfa Chemistry

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p-Toluenesulfonic Acid Methyl Ester

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Catalog Number

ACMA00017176

Product Name

p-Toluenesulfonic Acid Methyl Ester

Category

Polymers

IUPAC Name

methyl 4-methylbenzenesulfonate

Molecular Weight

186.23g/mol

Molecular Formula

C8H10O3S

Canonical SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC

InChI

InChI=1S/C8H10O3S/c1-7-3-5-8(6-4-7)12(9,10)11-2/h3-6H,1-2H3

InChI Key

VUQUOGPMUUJORT-UHFFFAOYSA-N

Boiling Point

292.0 °C;292 °C @ 760 MM HG

Melting Point

28.5 °C;28-29 °C

Flash Point

306 °F (152 °C) (open cup)

Density

1.230 @ 25 DEG/25 °C

Solubility

INSOL IN WATER; SLIGHTLY SOL IN PETROLEUM ETHER; SOL IN ETHER; VERY SOL IN ALCOHOL, BENZENE, CHLOROFORM

Color/Form

MONOCLINIC LEAFLETS OR PRISMS FROM ETHER-PETROLEUM ETHER;LIGHT BROWN CRYSTALS;WHITE DAMP CRYSTALS

Complexity

219

Covalently-Bonded Unit Count

EC Number

201-283-5

Exact Mass

186.035065g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

methyl 4-toluene sulfonate;methyl p-toluene sulfonate

Monoisotopic Mass

186.035065g/mol

NSC Number

406335

Other Experimental

LOW-MELTING SOLID OR LIQUID;DECOMP @ 262 °C

Rotatable Bond Count

UNII

4SU69KI68L

Vapor Density

6.45 (AIR= 1)

XLogP3

2.2

MSDS

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COA

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Spec Sheet

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