5-Methyl-1-hexyn-3-ol
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5-Methyl-1-hexyn-3-ol
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CAS No:
61996-79-0
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Formula:
C7H12O
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Chemical Name:
5-Methyl-1-hexyn-3-ol
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Synonyms:
5-methylhex-1-yn-3-ol;
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CAS No:
Safety Information
UN 1987 3/PG 3
R10
S16
Xn
|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:112.17
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:112.088815002
Monoisotopic Mass:112.088815002
Topological Polar Surface Area:20.2
Heavy Atom Count:8
Complexity:96.2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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