2-(2-Nitrophenyl)ethyl p-toluenesulfonate structure

2-(2-Nitrophenyl)ethyl p-toluenesulfonate

2-(2-nitrophenyl)ethyl 4-methylbenzenesulfonate

Also Known As: 2-Nitrophenethyl tosylate|2-(2-Nitrophenyl)ethyl 4-methylbenzenesulfonate|2-(2-nitrophenyl)ethyl 4-methylbenzene-1-sulfonate|2-(2-Nitrophenyl)ethyl p-toluenesulfonate|2-(2-nitrophenyl)-ethyl p-toluenesulfonate|2-(2-Nitrophenyl)ethyl 4-methylbenzenesulfonate #|Toluene-4-sulfonic acid, 2-(2-nitrophenyl)ethyl ester|636-224-6

CAS: 69628-96-2
Molecular Formula C15H15NO5S
Molecular Weight 321.0671 g/mol
LogP 3.4
Topological Polar Surface Area 97.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 321.0671
Monoisotopic Mass 321.0671
Heavy Atoms 22
Complexity 459.0

Chemical Identifiers

CAS Number 69628-96-2
SMILES CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC=CC=C2[N+](=O)[O-]
InChIKey FBLDLJMRGSZGCD-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (10 patents) Pharmaceutical Intermediates (12 patents)

Product Overview

2-(2-Nitrophenyl)ethyl p-toluenesulfonate (CAS 69628-96-2), with molecular formula C15H15NO5S and molecular weight 321.0671 g/mol. IUPAC: 2-(2-nitrophenyl)ethyl 4-methylbenzenesulfonate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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