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cis-Resveratrol

CAT: 0572-TRC-R150005-10MGSize: 10 mgDry Ice: YesHazardous: No
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CAT#:0572-TRC-R150005-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
61434-67-1
Hazard Statement
Harmful if swallowed
Purity
>95% (HPLC)
Smiles
Oc1ccc(\C=C/c2cc(O)cc(O)c2)cc1
Molecular Formula
C14 H12 O3
Molecular Weight
228.24
InChI
InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1-
Additionnal Information
IUPAC name: 5-[(Z)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol
Shipping Conditions
Dry Ice
Storage Conditions
-20°C

Chemical Information

Cis-Resveratrol

Cis-resveratrol is the cis-stereoisomer of resveratrol.

CAS Number61434-67-1
PubChem CID1548910
IUPAC Name5-[(Z)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol
Molecular FormulaC14H12O3
Molecular Weight228.24
XLogP3.1
Topological Polar Surface Area60.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity246
SMILES
C1=CC(=CC=C1/C=C\C2=CC(=CC(=C2)O)O)O
InChI
InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1-
InChIKey
LUKBXSAWLPMMSZ-UPHRSURJSA-N
Chemical Structure
2D Structure
2D structure of Cis-Resveratrol
CAS: 61434-67-1
CID: 1548910
Formula: C14H12O3
MW: 228.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight228.24
XLogP33.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass228.078644241
Monoisotopic Mass228.078644241
Topological Polar Surface Area60.7 Ų
Heavy Atom Count17
Formal Charge0
Complexity246
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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