Molecule ID: 14410

IUPAC Name: 1,2,3,4,5-pentabromo-6-(2,3,4,5,6-pentabromophenoxy)benzene

Description: The molecule is a polybromodiphenyl ether that is diphenyl ether in which all of the hydrogens have been replaced by bromines. It has a role as a neurotoxin.

SMILES: Brc1c(Br)c(Br)c(Oc2c(Br)c(Br)c(Br)c(Br)c2Br)c(Br)c1Br

SELFIES: [Br][C][=C][Branch1][C][Br][C][Branch1][C][Br][=C][Branch2][Ring1][#Branch1][O][C][=C][Branch1][C][Br][C][Branch1][C][Br][=C][Branch1][C][Br][C][Branch1][C][Br][=C][Ring1][#Branch2][Br][C][Branch1][C][Br][=C][Ring2][Ring1][Branch1][Br]

InChI: InChI=1S/C12Br10O/c13-1-3(15)7(19)11(8(20)4(1)16)23-12-9(21)5(17)2(14)6(18)10(12)22

Molecular Properties:
- Polar Surface Area: 9.2 Ų
- LogP: 10.4