CAS Registry Number®
97-06-3
CAS Name
4-Methyl-3-nitrobenzenesulfonic acid
Molecular Formula
C7H7NO5S
Molecular Mass
217.20
Compound Properties
-
Melting Point (1)
120-121 °C
Source(s)
- (1) Curd, Frank H.; Journal of the Chemical Society, (1933), 1166-7, CAplus
Other Names and Identifiers
InChI
InChI=1S/C7H7NO5S/c1-5-2-3-6(14(11,12)13)4-7(5)8(9)10/h2-4H,1H3,(H,11,12,13)
InChIKey
InChIKey=GJYYWZTYFNSZRP-UHFFFAOYSA-N
SMILES
N(=O)(=O)C1=CC(S(=O)(=O)O)=CC=C1C
Canonical SMILES
O=N(=O)C1=CC(=CC=C1C)S(=O)(=O)O
Other Names for this Substance
- Benzenesulfonic acid, 4-methyl-3-nitro-
- p-Toluenesulfonic acid, 3-nitro-
- 4-Methyl-3-nitrobenzenesulfonic acid
- 2-Nitrotoluene-4-sulfonic acid
- 1-Methyl-2-nitrobenzene-4-sulfonic acid
- o-Nitrotoluene-p-sulfonic acid
