CAS
94071-06-4 Purity
96%
94071-06-4 Purity
96%
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Specification
The molecular formula is C12H22O2.
It was created on 2007-12-05 and last modified on 2023-12-30.
The IUPAC name is [(Z)-hex-3-enyl] 2-ethylbutanoate.
The InChIKey is LFDWLVXNYKQQBT-FPLPWBNLSA-N.
It has 0 hydrogen bond donor counts.
The XLogP3-AA value is 3.6.
The topological polar surface area is 26.3 Å^2.
It has 8 rotatable bond counts.
It has 1 defined bond stereocenter count.
Yes, the compound is canonicalized.