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Carbonic acid, C,C'-[(1-methylethylidene)bis(2,6-dibromo-4,1-phenylene)] C,C'-bis(2,4,6-tribromophenyl) ester

HCID 104684
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
54060-67-2
Standard SMILES
CC(C)(c1cc(Br)c(OC(=O)Oc2c(Br)cc(Br)cc2Br)c(Br)c1)c1cc(Br)c(OC(=O)Oc2c(Br)cc(Br)cc2Br)c(Br)c1
InChIKey
XDZIBFQEYRXSBD-UHFFFAOYSA-N
Molecular formula
C29H14Br10O6
Average molar mass
1,257.5 g/mol
Monoisotopic mass
1,247.2624

Names & identifiers

Preferred name
Carbonic acid, C,C'-[(1-methylethylidene)bis(2,6-dibromo-4,1-phenylene)] C,C'-bis(2,4,6-tribromophenyl) ester
IUPAC
[2,6-dibromo-4-[2-[3,5-dibromo-4-(2,4,6-tribromophenoxy)carbonyloxyphenyl]propan-2-yl]phenyl] (2,4,6-tribromophenyl) carbonate
English name
2,2-Bis[3,5-dibromo-4-[[[(2,4,6-tribromophenyl)oxy]carbonyl]oxy]phenyl]propane
Molecular formula
C29H14Br10O6
Molecular weight
1257.46

Names & synonyms

Carbonic acid, C,C'-((1-methylethylidene)bis(2,6-dibromo-4,1-phenylene)) C,C'-bis(2,4,6-tribromophenyl) esterCarbonic acid, C,C'-[(1-methylethylidene)bis(2,6-dibromo-4,1-phenylene)] C,C'-bis(2,4,6-tribromophenyl) esterRefChem:57439754060-67-2Carbonic acid, (1-methylethylidene)bis(2,6-dibromo-4,1-phenylene) bis(2,4,6-tribromophenyl) esterDTXSID9068906SCHEMBL12245506XDZIBFQEYRXSBD-UHFFFAOYSA-NDB-323393(Propane-2,2-diyl)bis(2,6-dibromo-4,1-phenylene) bis(2,4,6-tribromophenyl) biscarbonate2,2-BIS[3,5-DIBROMO-4-[[[(2,4,6-TRIBROMOPHENYL)OXY]CARBONYL ]OXY]PHENYL ]PROPANE2,2-Bis[3,5-dibromo-4-[[[(2,4,6-tribromophenyl)oxy]carbonyl]oxy]phenyl]propane

Database identifiers

CAS
54060-67-2
PubChem CID
104684
DTXSID
DTXSID9068906
Nikkaji
J429.235I

Properties

Computed structural properties

XLogP
15.1
Topological polar surface area
71.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
10
Heavy atoms
45
Formal charge
0
Complexity
902

Physicochemical properties

EPA Substance Registry System
Carbonic acid, (1-methylethylidene)bis(2,6-dibromo-4,1-phenylene) bis(2,4,6-tribromophenyl) ester (54060-67-2)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationCarbonic acid, C,C'-[(1-methylethylidene)bis(2,6-dibromo-4,1-phenylene)] C,C'-bis(2,4,6-tribromophenyl) ester: INACTIVE

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes