CAS
94349-54-9 Purity
96%
94349-54-9 Purity
96%
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1-(8-Isopropyl-6-methylbicyclo[2.2.2]oct-5-en-2-yl)ethyl acetate
CAS
94349-59-4
Catalog Number
ACM94349594
Category
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What is the molecular formula of the compound with PubChem CID 44148259?
The molecular formula is C16H26O2.
What is the molecular weight of the compound?
The molecular weight is 250.38 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 1-(6-methyl-8-propan-2-yl-2-bicyclo[2.2.2]oct-5-enyl)ethyl acetate.
What is the InChI of the compound?
The InChI is InChI=1S/C16H26O2/c1-9(2)14-8-15-10(3)6-13(14)7-16(15)11(4)18-12(5)17/h6,9,11,13-16H,7-8H2,1-5H3.
What is the InChIKey of the compound?
The InChIKey is FBJZZRLZTRJKPC-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES is CC1=CC2CC(C1CC2C(C)C)C(C)OC(=O)C.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 2 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 4 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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