Phenyl 2-methyl-5-nitrobenzenesulfonate
CAS Registry Number®
85896-03-3
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CAS Name
Phenyl 2-methyl-5-nitrobenzenesulfonateMolecular Formula
C13H11NO5SMolecular Mass
293.30Cite this Page
Phenyl 2-methyl-5-nitrobenzenesulfonate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=85896-03-3 (retrieved ) (CAS RN: 85896-03-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C13H11NO5S/c1-10-7-8-11(14(15)16)9-13(10)20(17,18)19-12-5-3-2-4-6-12/h2-9H,1H3
InChIKey
InChIKey=DUEHZNNBLUTVHR-UHFFFAOYSA-N
SMILES
S(OC1=CC=CC=C1)(=O)(=O)C2=CC(N(=O)=O)=CC=C2C
Canonical SMILES
O=N(=O)C1=CC=C(C(=C1)S(=O)(=O)OC=2C=CC=CC2)C
Other Names for this Substance
- Benzenesulfonic acid, 2-methyl-5-nitro-, phenyl ester
- Phenyl 2-methyl-5-nitrobenzenesulfonate
- Phenyl 4-nitrotoluene-2-sulfonate