1-[(4-Methylphenyl)sulfonyl]-2-propanone
CAS Registry Number®
5366-49-4
CAS Name
1-[(4-Methylphenyl)sulfonyl]-2-propanoneMolecular Formula
C10H12O3SMolecular Mass
212.27Cite this Page
1-[(4-Methylphenyl)sulfonyl]-2-propanone. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=5366-49-4 (retrieved ) (CAS RN: 5366-49-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
167 °C @ Press: 0.1 TorrMelting Point (2)
50-51 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Billing, David G.; Acta Crystallographica, Section E: Structure Reports Online, (2006), 62(12), o5630-o5631, CAplus
Other Names and Identifiers
InChI
InChI=1S/C10H12O3S/c1-8-3-5-10(6-4-8)14(12,13)7-9(2)11/h3-6H,7H2,1-2H3
InChIKey
InChIKey=NDQXJNHOGLQSMB-UHFFFAOYSA-N
SMILES
S(CC(C)=O)(=O)(=O)C1=CC=C(C)C=C1
Canonical SMILES
O=C(C)CS(=O)(=O)C1=CC=C(C=C1)C
Other Names for this Substance
- 2-Propanone, 1-[(4-methylphenyl)sulfonyl]-
- 2-Propanone, 1-(p-tolylsulfonyl)-
- 2-Propanone, p-tolylsulfonyl-
- 1-[(4-Methylphenyl)sulfonyl]-2-propanone
- (p-Tolylsulfonyl)acetone