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(−) -β-Pinene

CAT: 0957-S6275Size: 25 µLDry Ice: NoHazardous: No
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CAT#:0957-S6275Size:25 µL
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Description
(−) -β-Pinene (Nopinene) is a natural organic compound in various plants. It is lethal to S. littoralis third instar larvae (LD50 = 65 μg/larva), inhibits infectious bronchitis virus (IBV) replication (IC50 = 1.32 mM) and exhibits a cytotoxic concentration (CC50) value of greater than 10 mM in Vero cells.
CAS Number
18172-67-3
Synonyms
Nopinene
Target
Others
Activity
Others
Molecular Formula
C10H16
Storage Conditions
2 years -20°C liquid

Chemical Information

(-)-beta-Pinene

(-)-beta-pinene is the (1S,5S)-enantiomer of beta-pinene. It is an enantiomer of a (+)-beta-pinene.

CAS Number18172-67-3
PubChem CID440967
IUPAC Name(1S,5S)-6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane
Molecular FormulaC10H16
Molecular Weight136.23
XLogP3.1
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity176
SMILES
CC1([C@H]2CCC(=C)[C@@H]1C2)C
InChI
InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3/t8-,9-/m0/s1
InChIKey
WTARULDDTDQWMU-IUCAKERBSA-N
Chemical Structure
2D Structure
2D structure of (-)-beta-Pinene
CAS: 18172-67-3
CID: 440967
Formula: C10H16
MW: 136.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight136.23
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass136.125200510
Monoisotopic Mass136.125200510
Topological Polar Surface Area0 Ų
Heavy Atom Count10
Formal Charge0
Complexity176
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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