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2,4,6-Tribromophenyl 5-bromopentanoate

HCID 5154686
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Basic information

CAS
300381-09-3
Standard SMILES
O=C(CCCCBr)Oc1c(Br)cc(Br)cc1Br
InChIKey
KNROLIWSTVGQGB-UHFFFAOYSA-N
Molecular formula
C11H10Br4O2
Average molar mass
493.81 g/mol
Monoisotopic mass
489.74143

Names & identifiers

Preferred name
2,4,6-Tribromophenyl 5-bromopentanoate
IUPAC
(2,4,6-tribromophenyl) 5-bromopentanoate

Names & synonyms

2,4,6-tribromophenyl 5-bromopentanoateDTXSID701282581AKOS024456313300381-09-3

Database identifiers

CAS
300381-09-3
PubChem CID
5154686
DTXSID
DTXSID701282581

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
17
Formal charge
0
Complexity
238

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Compound notes

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