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Dihydrosinapyl alcohol

CAT: 1410-M29296-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1410-M29296-01Size:10 mg
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Description
Dihydrosinapyl alcohol is a natural product from Clerodendranthus spicatus.
CAS Number
20736-25-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
212.24
Molecular Formula
C11H16O4
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

4-(3-Hydroxypropyl)-2,6-Dimethoxyphenol
CAS Number20736-25-8
PubChem CID529893
IUPAC Name4-(3-hydroxypropyl)-2,6-dimethoxyphenol
Molecular FormulaC11H16O4
Molecular Weight212.24
XLogP1.4
Topological Polar Surface Area58.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count15
Formal Charge0
Complexity160
SMILES
COC1=CC(=CC(=C1O)OC)CCCO
InChI
InChI=1S/C11H16O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h6-7,12-13H,3-5H2,1-2H3
InChIKey
PHOPGVYKZWPIGA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(3-Hydroxypropyl)-2,6-Dimethoxyphenol
CAS: 20736-25-8
CID: 529893
Formula: C11H16O4
MW: 212.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight212.24
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass212.10485899
Monoisotopic Mass212.10485899
Topological Polar Surface Area58.9 Ų
Heavy Atom Count15
Formal Charge0
Complexity160
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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CatalogName
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