Isophos 3
[CAS# 42585-08-0]

Identification

• Name: Isophos 3
• Synonyms: 4-Chloro-5-(Chloromethyl-Sec-Butyl-Phosphinothioyl)Oxy-2-Methyl-Aniline; 4-Chloro-5-(Chloromethyl-Sec-Butylphosphinothioyl)Oxy-2-Methylaniline; [4-Chloro-5-(Chloromethyl-Sec-Butyl-Thiophosphoryl)Oxy-2-Methyl-Phenyl]Amine
• Molecular Formula: C₁₂H₁₈Cl₂NOPS
• Molecular Weight: 326.22
• CAS Registry Number: 42585-08-0
• SMILES: C1=C(C(=CC(=C1C)N)O[P](C(CC)C)(=S)CCl)Cl
• InChI: 1S/C12H18Cl2NOPS/c1-4-9(3)17(18,7-13)16-12-6-11(15)8(2)5-10(12)14/h5-6,9H,4,7,15H2,1-3H3
• InChIKey: NNDMGAZBSIMXQD-UHFFFAOYSA-N

Properties

• Density: 1.286g/cm³ (Cal.)
• Boiling point: 428.24°C at 760 mmHg (Cal.)
• Flash point: 212.792°C (Cal.)