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(R) - (-) -α-Phellandrene

CAT: 0013-GTR19184105-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19184105-02Size:100 mg
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Description
(-) -5-Isopropyl-2-Methyl-1,3-Cyclohexadiene
CAS Number
4221-98-1
Field of Research
Infectious Disease & Virology
Smiles
CC (C) [C@@H]1C=CC (C) =CC1
Molecular Formula
C10H16
Molecular Weight
136.23
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

alpha-PHELLANDRENE, (-)-

(-)-alpha-phellandrene is the (R)-()-stereoisomer of alpha-phellandrene. It is an enantiomer of a (+)-alpha-phellandrene.

CAS Number4221-98-1
PubChem CID442482
IUPAC Name(5R)-2-methyl-5-propan-2-ylcyclohexa-1,3-diene
Molecular FormulaC10H16
Molecular Weight136.23
XLogP3.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity161
SMILES
CC1=CC[C@@H](C=C1)C(C)C
InChI
InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4-6,8,10H,7H2,1-3H3/t10-/m1/s1
InChIKey
OGLDWXZKYODSOB-SNVBAGLBSA-N
Chemical Structure
2D Structure
2D structure of alpha-PHELLANDRENE, (-)-
CAS: 4221-98-1
CID: 442482
Formula: C10H16
MW: 136.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight136.23
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass136.125200510
Monoisotopic Mass136.125200510
Topological Polar Surface Area0 Ų
Heavy Atom Count10
Formal Charge0
Complexity161
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

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