3,5-Dimethyloctane
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3,5-Dimethyloctane
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CAS No:
15869-93-9
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Formula:
C10H22
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Chemical Name:
3,5-Dimethyloctane
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Synonyms:
Octane,3,5-dimethyl-;3,5-Dimethyloctane
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CAS No:
Description
3,5-dimethyloctane is an alkane that is octane substituted by methyl groups at positions 3 and 5. Metabolite observed in cancer metabolism. It has a role as a human metabolite. It derives from a hydride of an octane.
Safety Information
|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:142.28
XLogP3:5.1
Rotatable Bond Count:5
Exact Mass:142.172150702
Monoisotopic Mass:142.172150702
Heavy Atom Count:10
Complexity:66.4
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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InquiryCAS No.: 15869-93-9Grade: Pharmaceutical GradeContent: 99%
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