Tris(1,3-dichloro-2-propyl)phosphate

Synonyms: TDCPP, "Fyrol FR 2", "tris(1,3-dichloropropan-2-yl) phosphate", "Tris(1,3-dichloro-2-propyl)phosphate", "Emulsion 212", "Phosphoric Acid Tris(1,3-dichloro-2-propyl) Ester", "2-Propanol, 1,3-dichloro-, phosphate (3:1)", "Tris(1,3-dichloroisopropyl)phosphate", "CRP (fireproofing agent)", "PF 38", "Fyrol FR-2", "1,3-Dichloro-2-propanol phosphate (3:1)", "UNII-B1PRV4G0T0", "Tris(1-chloromethyl-2-chloroethyl)phosphate", "Tri(beta,beta'-dichloroisopropyl)phosphate"

Source: tris(1,3-dichloro-2-propyl)phosphate is a flame retardant widely used in furniture containing polyurethane foam.

Identifiers:

IUPAC Name: tris(1,3-dichloropropan-2-yl) phosphate
CAS Number: 13674-87-8
PubChem ID: 26177
InChiKey: ASLWPAWFJZFCKF-UHFFFAOYSA-N
Canonical SMILES: C(C(CCl)OP(=O)(OC(CCl)CCl)OC(CCl)CCl)Cl

Structural Properties:

Molecular Formula: C₉H₁₅Cl₆O₄P
Molecular Weight: 430,900

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 4
Number of atoms different from hydrogen: 20

Downloads

2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

Search Similar molecules

Evidence Supporting This Chemical as an Emerging Contaminant

Blum, K. M., Andersson, P. L., Ahrens, L., Wiberg, K., & Haglund, P. (2018). Persistence, mobility and bioavailability of emerging organic contaminants discharged from sewage treatment plants. Science of the Total Environment, 612, 1532-1542.

External Links

PubChem

PubMed (general search)

PubMed (search as emerging contaminant)

2D-structure

3D-structure