CAS
945419-64-7 Purity
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945419-64-7 Purity
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4-Acetoxy-beta-damascone
CAS
945426-71-1
Catalog Number
ACM945426711
Category
Other Products
Molecular Weight
250.33
Molecular Formula
C15H22O3
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Specification
Synonyms
(2E)-1-[3-(Acetyloxy)-2,6,6-trimethyl-1-cyclohexen-1-yl]-2-buten-1-one
IUPAC Name
(3-but-2-enoyl-2,4,4-trimethylcyclohex-2-en-1-yl) acetate
Canonical SMILES
CC=CC(=O)C1=C(C(CCC1(C)C)OC(=O)C)C
InChI Key
GEDDTPMAMRHVHC-UHFFFAOYSA-N
Appearance
White Solid
Exact Mass
250.15700
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 4-Acetoxy-beta-damascone?
The molecular formula of 4-Acetoxy-beta-damascone is C15H22O3.
What is the molecular weight of 4-Acetoxy-beta-damascone?
The molecular weight of 4-Acetoxy-beta-damascone is 250.33 g/mol.
When was 4-Acetoxy-beta-damascone created according to PubChem?
4-Acetoxy-beta-damascone was created on 2007-02-09.
How many hydrogen bond donor counts does 4-Acetoxy-beta-damascone have?
4-Acetoxy-beta-damascone has 0 hydrogen bond donor counts.
What is the XLogP3-AA value of 4-Acetoxy-beta-damascone?
The XLogP3-AA value of 4-Acetoxy-beta-damascone is 2.7.
Is 4-Acetoxy-beta-damascone canonicalized according to PubChem?
Yes, 4-Acetoxy-beta-damascone is canonicalized according to PubChem.
What is the topological polar surface area of 4-Acetoxy-beta-damascone?
The topological polar surface area of 4-Acetoxy-beta-damascone is 43.4?2.
How many rotatable bond counts does 4-Acetoxy-beta-damascone have?
4-Acetoxy-beta-damascone has 4 rotatable bond counts.
How many heavy atom counts does 4-Acetoxy-beta-damascone have?
4-Acetoxy-beta-damascone has 18 heavy atom counts.
What is the InChIKey of 4-Acetoxy-beta-damascone?
The InChIKey of 4-Acetoxy-beta-damascone is DXCWYEWUFIWPQN-VOTSOKGWSA-N.
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945426-70-0 Purity
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