Triclosan

• CAS: 3380-34-5
• Catalog Number: ACM3380345
• Category: Inhibitors
• Molecular Weight: 289.54
• Molecular Formula: C12H7Cl3O2
• Description: Triclosan is an antibacterial and antifungal agent found in consumer products, including soaps, detergents, toys, and surgical cleaning treatments.
• Synonyms: Trichloro-2'-hydroxydiphenylether
• IUPAC Name: 5-Chloro-2-(2,4-dichlorophenoxy)phenol
• Canonical SMILES: C1=CC(=C(C=C1Cl)O)OC2=C(C=C(C=C2)Cl)Cl
• InChI: InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
• InChI Key: XEFQLINVKFYRCS-UHFFFAOYSA-N
• Boiling Point: 290 °C(lit.)
• Melting Point: 56-60 °C(lit.)
• Density: 1.4214 g/cm³
• Solubility: Slightly soluble in water
• Appearance: Solid
• Storage: 2-8 °C
• Complexity: 252
• Exact Mass: 287.951163
• Monoisotopic Mass: 287.951163
• pKa: 7.9(at 25 °C)
• Refractive Index: 1.4521
• Shipping: Can be shipped at room temperature, where not in use may vary.
• Topological Polar Surface Area: 29.5 Ų

Synthetic Use

Upstream Synthesis Route 1

• 88-12-0
• 156722-99-5

• 3380-34-5

Reference: [1] Patent: US6315987, 2001, B1,

Upstream Synthesis Route 2

• 15687-27-1

• 3380-34-5

Reference: [1] Patent: US2011/230561, 2011, A1,

Upstream Synthesis Route 3

• 103-90-2

• 3380-34-5

Reference: [1] Patent: US2011/230561, 2011, A1,

Downstream Synthesis Route 1

• 75-44-5
• 3380-34-5

• 28395-73-5

Reference: [1]Patent: DE2004302,1970,

Downstream Synthesis Route 2

• 16911-89-0
• 3380-34-5

• 26012-16-8

Reference: [1]Patent: CH477160,1969,

Downstream Synthesis Route 3

• 39974-79-3
• 3380-34-5

• 25995-65-7

Reference: [1]Patent: CH477160,1969,

* For details of the synthesis route, please refer to the original source to ensure accuracy.