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Reference substances

Reference substances

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General information

Inventory

EC number:
306-832-3
EC name:
1,1'-(isopropylidene)bis[3,5-dibromo-4-(2,3-dibromo-2-methylpropoxy)benzene]
CAS number:
97416-84-7

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Reference substance information

IUPAC name:
1,3-dibromo-2-(2,3-dibromo-2-methylpropoxy)-5-{2-[3,5-dibromo-4-(2,3-dibromo-2-methylpropoxy)phenyl]propan-2-yl}benzene
Synonyms
Names:
1,1'-(isopropylidene)bis[3,5-dibromo-4-(2,3-dibromo-2-methylpropoxy)benzene]
Identifier:
CAS number
97416-84-7
Identifier:
IUPAC name
1,1'-propane-2,2-diylbis[3,5-dibromo-4-(2,3-dibromo-2-methylpropoxy)benzene]
Identifier:
IUPAC name
1,3-dibromo-2-(2,3-dibromo-2-methylpropoxy)-5-{2-[3,5-dibromo-4-(2,3-dibromo-2-methylpropoxy)phenyl]propan-2-yl}benzene
Identifier:
other: SMILES notation
CC(Br)(CBr)COC1=C(Br)C=C(C=C1Br)C(C)(C)C1=CC(Br)=C(OCC(C)(Br)CBr)C(Br)=C1
Identifier:
other: InChl
InChI=1/C23H24Br8O2/c1-21(2,13-5-15(26)19(16(27)6-13)32-11-22(3,30)9-24)14-7-17(28)20(18(29)8-14)33-12-23(4,31)10-25/h5-8H,9-12H2,1-4H3
1,1'-(isopropylidene)bis[3,5-dibromo-4-(2,3-dibromo-2-methylpropoxy)benzene]

CAS information

CAS number:
97416-84-7

Molecular and structural information

Molecular formula:
C23H24Br8O2
Molecular weight:
971.67
SMILES notation:
CC(Br)(CBr)COc1c(Br)cc(cc1Br)C(C)(C)c2cc(Br)c(OCC(C)(Br)CBr)c(Br)c2
InChl:
InChI=1/C23H24Br8O2/c1-21(2,13-5-15(26)19(16(27)6-13)32-11-22(3,30)9-24)14-7-17(28)20(18(29)8-14)33-12-23(4,31)10-25/h5-8H,9-12H2,1-4H3
Structural formula:
Chemical structure