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Dihydropinosylvin dimethyl ether

CAT: 1410-M39288-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Dihydropinosylvin dimethyl ether
CAS Number
78916-50-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
242.3
Molecular Formula
C16H18O2
Notes
Research use only, not for human use.
Receptor
Other Targets

Chemical Information

Benzene, 1,3-dimethoxy-5-(2-phenylethyl)-

Benzene, 1,3-dimethoxy-5-(2-phenylethyl)- is a stilbenoid.

CAS Number78916-50-4
PubChem CID10538117
IUPAC Name1,3-dimethoxy-5-(2-phenylethyl)benzene
Molecular FormulaC16H18O2
Molecular Weight242.31
XLogP4.1
Topological Polar Surface Area18.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count18
Formal Charge0
Complexity211
SMILES
COC1=CC(=CC(=C1)CCC2=CC=CC=C2)OC
InChI
InChI=1S/C16H18O2/c1-17-15-10-14(11-16(12-15)18-2)9-8-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3
InChIKey
PBHUJCQHJCTMDJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzene, 1,3-dimethoxy-5-(2-phenylethyl)-
CAS: 78916-50-4
CID: 10538117
Formula: C16H18O2
MW: 242.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight242.31
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass242.130679813
Monoisotopic Mass242.130679813
Topological Polar Surface Area18.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity211
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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