3,6,7-Trimethyl-6-octen-1-yn-3-ol
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3,6,7-Trimethyl-6-octen-1-yn-3-ol
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CAS No:
52567-96-1
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Formula:
C11H18O
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Chemical Name:
3,6,7-Trimethyl-6-octen-1-yn-3-ol
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Synonyms:
6-Octen-1-yn-3-ol,3,6,7-trimethyl-;3,6,7-Trimethyl-6-octen-1-yn-3-ol
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CAS No:
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:166.26
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:166.135765193
Monoisotopic Mass:166.135765193
Topological Polar Surface Area:20.2
Heavy Atom Count:12
Complexity:225
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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