1,9-Dibromononane
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1,9-Dibromononane
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CAS No:
4549-33-1
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Formula:
C9H18Br2
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Chemical Name:
1,9-Dibromononane
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Synonyms:
Nonane,1,9-dibromo-;1,9-Dibromononane;NSC 62682
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CAS No:
Safety Information
NONH for all modes of transport
3
R36/37/38
S26-S36
Xi: Irritant;
P261-P305 + P351 + P338
H315-H319-H335
|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 42 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1,9-Dibromononane Use and Manufacturing
General procedure: To an open oven-dried reaction vial charged with a stir bar was added copper catalyst (2 mg, 0.002 mmol, 0.01 equiv), the alcohol (0.20 mmol, 1.0 equiv), carbon tetrabromide (131.6 mg, 0.4mmol, 2.0 equiv) and sodium bromide (41 mg, 0.40 mmol, 2.0 equiv). The flask vial was capped, purged with a stream of nitrogen and dry DMF (1.5 mL) was added via syringe. The reactionmixture was stirred under purple LEDs (394 nm) for 24 h. The vessel was opened and the mixturewas poured into a separatory funnel containing Et2O (10 mL) and H2O (10 mL). The layers wereseparated, and the aqueous layer was extracted with Et2O (2 × 10 mL). The combined organiclayers were washed with sat. Na2S2O3 solution, brine, dried over Na2SO4 and concentrated invacuo. The residue was purified by chromatography (100 percent hexanes)
Nonane, 1,9-dibromo-: ACTIVE
Computed Properties
Molecular Weight:286.05
XLogP3:5.3
Rotatable Bond Count:8
Exact Mass:285.97548
Monoisotopic Mass:283.97753
Heavy Atom Count:11
Complexity:56.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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