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Pentan-2-Yl 4-Methylbenzenesulfonate
[CAS# 3813-69-2]

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Achemica Switzerland Inquire  
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Chemical manufacturer since 2010
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Zylexa Pharma Ltd. UK Inquire  
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Identification
Name Pentan-2-Yl 4-Methylbenzenesulfonate
Synonyms 1-Methylbutyl 4-Methylbenzenesulfonate; 4-Methylbenzenesulfonic Acid 1-Methylbutyl Ester; Brn 2417601
Molecular Structure CAS#: 3813-69-2, Pentan-2-Yl 4-Methylbenzenesulfonate
Molecular Formula C12H18O3S
Molecular Weight 242.33
CAS Registry Number 3813-69-2
SMILES C1=CC(=CC=C1[S](=O)(=O)OC(CCC)C)C
InChI 1S/C12H18O3S/c1-4-5-11(3)15-16(13,14)12-8-6-10(2)7-9-12/h6-9,11H,4-5H2,1-3H3
InChIKey HQSHAZLGVDYADJ-UHFFFAOYSA-N
Properties
Density 1.1g/cm3 (Cal.)
Boiling point 343.943°C at 760 mmHg (Cal.)
Flash point 161.811°C (Cal.)
Refractive index 1.5005 (Expl.)
Market Analysis Reports
List of Reports Available for Pentan-2-Yl 4-Methylbenzenesulfonate
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