2,5-Dibromo-3,4-hexanedione
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2,5-Dibromo-3,4-hexanedione
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CAS No:
39081-91-9
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Formula:
C6H8Br2O2
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Chemical Name:
2,5-Dibromo-3,4-hexanedione
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Synonyms:
3,4-Hexanedione,2,5-dibromo-;2,5-Dibromo-3,4-hexanedione
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CAS No:
Characteristics
34.14000
1.69140
1.766 g/mL at 25ºC(lit.)
54-55 °C
100-103 °C @ Press: 10 Torr
113 °C
n20/D 1.512(lit.)
Safety Information
36/37/38
26-37/39
Xi
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:271.93
XLogP3:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:271.88706
Monoisotopic Mass:269.88910
Topological Polar Surface Area:34.1
Heavy Atom Count:10
Complexity:138
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes