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P-TOLUENESULFONIC ACID N-BUTYL ESTER

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P-TOLUENESULFONIC ACID N-BUTYL ESTER Basic information

Product Name:
P-TOLUENESULFONIC ACID N-BUTYL ESTER
Synonyms:
  • butyltosylate
  • p-Toluenesulfonic acid, butyl ester
  • p-toluenesulfonicacid,butylester
  • P-TOLUENESULFONIC ACID N-BUTYL ESTER
  • N-BUTYLTOSYLATE
  • N-BUTYL P-TOLUENESULFONATE
  • 4-METHYLBENZENESULFONIC ACID, BUTYL ESTER
  • BUTYL 4-TOLUENESULFONATE
CAS:
778-28-9
MF:
C11H16O3S
MW:
228.31
EINECS:
212-295-5
Mol File:
778-28-9.mol
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P-TOLUENESULFONIC ACID N-BUTYL ESTER Chemical Properties

Boiling point:
170-172 °C (10 mmHg)
Density 
1.12
vapor pressure 
0.031Pa at 25℃
refractive index 
1.503-1.505
storage temp. 
Inert atmosphere,Room Temperature
solubility 
Chloroform (Slightly), DMSO (Sparingly)
form 
Liquid
color 
Clear light yellow to brownish
Water Solubility 
44.9mg/L at 20℃
InChI
InChI=1S/C11H16O3S/c1-3-4-9-14-15(12,13)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3
InChIKey
QYJXDIUNDMRLAO-UHFFFAOYSA-N
SMILES
C1(S(OCCCC)(=O)=O)=CC=C(C)C=C1
LogP
2.8 at 20℃
CAS DataBase Reference
778-28-9(CAS DataBase Reference)
EPA Substance Registry System
Benzenesulfonic acid, 4-methyl-, butyl ester (778-28-9)
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Safety Information

Hazard Codes 
Xn
Risk Statements 
36/37/38-22
Safety Statements 
37/39-26
RTECS 
XT6400000
HS Code 
29041000

MSDS

  • Language:English Provider:ACROS
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P-TOLUENESULFONIC ACID N-BUTYL ESTER Usage And Synthesis

Chemical Properties

clear light yellow to brownish liquid

Uses

Butyl 4-Methylbenzenesulfonate is used in preparation of highly-branched chain Ammonium Dicarboxylate Salt.

Flammability and Explosibility

Not classified

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