tris[2,2-bis[2,3-bis(bromanyl)propoxymethyl]butyl] borate

Systemtic Name: tris[2,2-bis[2,3-bis(bromanyl)propoxymethyl]butyl] borate Openeye Name: tris[2,2-bis(2,3-dibromopropoxymethyl)butyl] borate CAS Name: tris[2,2-bis(2,3-dibromopropoxymethyl)butyl] borate IUPAC Name: tris[2,2-bis(2,3-dibromopropoxymethyl)butyl] borate Traditional Name: tris[2,2-bis(2,3-dibromopropoxymethyl)butyl] borate Formula: C36H63BBr12O9 MolecularWeight: 1609.53902

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Descriptors Computed from Structure

Canonical SMILES:

B(OCC(CC)(COCC(CBr)Br)COCC(CBr)Br)(OCC(CC)(COCC(CBr)Br)COCC(CBr)Br)OCC(CC)(COCC(CBr)Br)COCC(CBr)Br

Isomeric SMILES

B(OCC(CC)(COCC(CBr)Br)COCC(CBr)Br)(OCC(CC)(COCC(CBr)Br)COCC(CBr)Br)OCC(CC)(COCC(CBr)Br)COCC(CBr)Br

InChI

InChI=1S/C36H63BBr12O9/c1-4-34(19-50-13-28(44)7-38,20-51-14-29(45)8-39)25-56-37(57-26-35(5-2,21-52-15-30(46)9-40)22-53-16-31(47)10-41)58-27-36(6-3,23-54-17-32(48)11-42)24-55-18-33(49)12-43/h28-33H,4-27H2,1-3H3