chempirical

Tris(2,3-dibromopropyl) phosphate

C9H15Br6O4PCAS 126-72-7697.61 g/mol

Open in Covalent MOL file
OPOBrBrOBrBrOBrBr
Alkyl halidePhosphate

Properties

Molecular formula
C9H15Br6O4P
Molar mass
697.61 g/mol
Exact mass
691.5808 Da
Density
2.27 g/mL (at 25 °C)
Melting point
5.5 °C
logP
5.62Crippen estimate
Polar surface area
44.8 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
12

Identifiers

CAS number
126-72-7
SMILES
O=P(OCC(Br)CBr)(OCC(Br)CBr)OCC(Br)CBr
InChIKey
PQYJRMFWJJONBO-UHFFFAOYSA-N
InChI
InChI=1S/C9H15Br6O4P/c10-1-7(13)4-17-20(16,18-5-8(14)2-11)19-6-9(15)3-12/h7-9H,1-6H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

24 names · show all
  • 1-Propanol, 2,3-dibromo-, 1,1′,1′′-phosphate
  • 1-Propanol, 2,3-dibromo-, phosphate (3:1)
  • Phosphoric acid, tris(2,3-dibromopropyl) ester
  • FireMaster T 23P
  • T 23P
  • Apex 462-5
  • FireMaster LV-T 23P
  • Zetofex ZN
  • ES 685
  • Flammex AP
  • Flammex T 23P
  • Bromkal P 67-6HP
  • Fyrol HB 32
  • Tris
  • Tris (flame retardant)
  • TDBPP
  • Phoscon PE 60
  • 3PBR
  • Flammex LV-T 23P
  • Phoscon UF-S
  • FireMaster T 23
  • Phoscon FR 150
  • NSC 3240
  • Unflame 3PB

Work with Tris(2,3-dibromopropyl) phosphate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Triisobutyl phosphate126-71-643 % similar 2,3-Dibromopropyl acrylate19660-16-339 % similar Tris(2-chloropropyl) phosphate6145-73-939 % similar 1,2-Dibromobutane533-98-236 % similar 1,2-Dibromo-3-chloropropane96-12-836 % similar 2,3-Dibromo-1-propanol96-13-936 % similar Tris(tribromoneopentyl) phosphate19186-97-135 % similar Tripropyl phosphate513-08-634 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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