3-(4-Methyl-2-Nitrophenoxy)Propane-1-Sulfonic Acid
[CAS# 79817-53-1]

Identification

• Name: 3-(4-Methyl-2-Nitrophenoxy)Propane-1-Sulfonic Acid
• Synonyms: 3-(4-Methyl-2-Nitro-Phenoxy)Propane-1-Sulfonic Acid; 3-(4-Methyl-2-Nitrophenoxy)Propanesulphonic Acid
• Molecular Formula: C₁₀H₁₃NO₆S
• Molecular Weight: 275.28
• CAS Registry Number: 79817-53-1
• EINECS: 279-284-5
• SMILES: C1=C(C=CC(=C1[N+]([O-])=O)OCCC[S](O)(=O)=O)C
• InChI: 1S/C10H13NO6S/c1-8-3-4-10(9(7-8)11(12)13)17-5-2-6-18(14,15)16/h3-4,7H,2,5-6H2,1H3,(H,14,15,16)
• InChIKey: USOXFCZQOCMJEH-UHFFFAOYSA-N

Properties

• Density: 1.426g/cm³ (Cal.)