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(+)-Alpha-Cyperone

CAT: 0572-TRC-C989595-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C989595-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
473-08-5
Synonyms
2(3H)-Naphthalenone, 4,4a,5,6,7,8-hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-, (4aS,7R)-; 2(3H)-Naphthalenone, 4,4a,5,6,7,8-hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-, (4aS-cis)-; Eudesma-4,11-dien-3-one (7CI,8CI); α-Cyperone (6CI); (+)-α-Cyperone; (4aS,7R)-4,4a,5,6,7,8-Hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(3H)-naphthalenone; α-Cyperone, (+)-
Hazard Statement
Not a hazardous substance according to GHS.
Smiles
CC(=C)[C@@H]1CC[C@@]2(C)CCC(=O)C(=C2C1)C
Molecular Formula
C15 H22 O
Molecular Weight
218.33
InChI
InChI=1S/C15H22O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12H,1,5-9H2,2-4H3/t12-,15+/m1/s1
Additionnal Information
IUPAC name: (4aS,7R)-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

(+)-alpha-Cyperone

alpha-Cyperone has been reported in Swertia japonica, Artemisia herba-alba, and other organisms with data available.

CAS Number473-08-5
PubChem CID6452086
IUPAC Name(4aS,7R)-1,4a-dimethyl-7-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one
Molecular FormulaC15H22O
Molecular Weight218.33
XLogP3.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count16
Formal Charge0
Complexity375
SMILES
CC1=C2C[C@@H](CC[C@]2(CCC1=O)C)C(=C)C
InChI
InChI=1S/C15H22O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12H,1,5-9H2,2-4H3/t12-,15+/m1/s1
InChIKey
KUFXJZXMWHNCEH-DOMZBBRYSA-N
Chemical Structure
2D Structure
2D structure of (+)-alpha-Cyperone
CAS: 473-08-5
CID: 6452086
Formula: C15H22O
MW: 218.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight218.33
XLogP33.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass218.167065321
Monoisotopic Mass218.167065321
Topological Polar Surface Area17.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity375
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
T5S1981-01Alpha-Cyperone
299907Alpha Cyperone
A15413-20Alpha-Cyperone 20mg
A15413-5Alpha-Cyperone 5mg
HY-N0710R-01Alpha-Cyperone (Standard)
A15413-25Alpha-Cyperone 25mg
A15413-50Alpha-Cyperone 50mg
A15413-10Alpha-Cyperone 10mg
A15413-1Alpha-Cyperone 1mg
464937α-Cyperone

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