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(R)-(-)-Curcumene

CAT: 0572-TRC-C417610-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C417610-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
4176-17-4
Hazard Statement
No Data Available
Smiles
C[C@H](CCC=C(C)C)c1ccc(C)cc1
Molecular Formula
C15 H22
Molecular Weight
202.335
InChI
InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3/t14-/m1/s1
Additionnal Information
IUPAC name: 1-methyl-4-[(2R)-6-methylhept-5-en-2-yl]benzene
Shipping Conditions
Room Temperature

Chemical Information

(-)-alpha-Curcumene

(-)-alpha-curcumene is an alpha-curcumene that has R configuration at the chiral centre. It has a role as a metabolite. It is an enantiomer of a (+)-alpha-curcumene.

CAS Number4176-17-4
PubChem CID442360
IUPAC Name1-methyl-4-[(2R)-6-methylhept-5-en-2-yl]benzene
Molecular FormulaC15H22
Molecular Weight202.33
XLogP5.4
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity190
SMILES
CC1=CC=C(C=C1)[C@H](C)CCC=C(C)C
InChI
InChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3/t14-/m1/s1
InChIKey
VMYXUZSZMNBRCN-CQSZACIVSA-N
Chemical Structure
2D Structure
2D structure of (-)-alpha-Curcumene
CAS: 4176-17-4
CID: 442360
Formula: C15H22
MW: 202.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight202.33
XLogP35.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count4
Exact Mass202.172150702
Monoisotopic Mass202.172150702
Topological Polar Surface Area0 Ų
Heavy Atom Count15
Formal Charge0
Complexity190
Isotope Atom Count0
Defined Atom Stereocenter Count1
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
HY-W751460(R) - (-) -Curcumene
RM-A065210-01α-Curcumene
HY-N9691-01Curcumene
GTR19260567(-) -α-Curcumene
GTR19260564β-Curcumene
JH918203Beta-Curcumene
MBS5788842alpha-curCumene
MBS5761901ar-Curcumene
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