chempirical

Tris(tribromoneopentyl) phosphate

C15H24Br9O4PCAS 19186-97-11018.46 g/mol

Open in Covalent MOL file
OPOBrBrBrOBrBrBrOBrBrBr
Alkyl halidePhosphate

Properties

Molecular formula
C15H24Br9O4P
Molar mass
1018.46 g/mol
Exact mass
1009.4063 Da
Melting point
172–173 °C
logP
8.66Crippen estimate
Polar surface area
44.8 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
18

Identifiers

CAS number
19186-97-1
SMILES
O=P(OCC(CBr)(CBr)CBr)(OCC(CBr)(CBr)CBr)OCC(CBr)(CBr)CBr
InChIKey
BHYQWBKCXBXPKM-UHFFFAOYSA-N
InChI
InChI=1S/C15H24Br9O4P/c16-1-13(2-17,3-18)10-26-29(25,27-11-14(4-19,5-20)6-21)28-12-15(7-22,8-23)9-24/h1-12H2

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

Names and synonyms

16 names · show all
  • 1-Propanol, 3-bromo-2,2-bis(bromomethyl)-, 1,1′,1′′-phosphate
  • Reoflam FR 370
  • TexFRon 3000
  • FR 680
  • SR 370
  • 1-Propanol, 3-bromo-2,2-bis(bromomethyl)-, phosphate (3:1)
  • Tris[3-bromo-2,2-bis(bromomethyl)propyl] phosphate
  • Tris[2,2-bis(bromomethyl)-3-bromopropyl] phosphate
  • CR 900
  • Flame cut 175R
  • TPB 3070
  • Flame cut 175
  • Kronitex PB 370
  • PB 370
  • FR 370
  • FR 372

Work with Tris(tribromoneopentyl) 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

1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane5301-78-054 % similar 3,3-Bis(bromomethyl)oxetane2402-83-742 % similar Tris(2,3-dibromopropyl) phosphate126-72-735 % similar Triethyl phosphate78-40-035 % similar Tris(2,2,3,3,4,4,5,5-octafluoropentyl) phosphate355-86-233 % similar Tris(2-chloroethyl) phosphate115-96-832 % similar Tripropyl phosphate513-08-632 % similar Antiblaze 104542595-45-931 % similar

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

Elsewhere

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