Structure Database (LMSD)

Common Name
4,4'-Dihydroxystilbene
Systematic Name
Synonyms
LM ID
LMPK13090018
Formula
Exact Mass
Calculate m/z
212.08373
Status
Active

Classification

String Representations

InChiKey (Click to copy)
XLAIWHIOIFKLEO-OWOJBTEDSA-N
InChi (Click to copy)
InChI=1S/C14H12O2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h1-10,15-16H/b2-1+
SMILES (Click to copy)
C1(O)=CC=C(/C=C/C2=CC=C(O)C=C2)C=C1

Other Databases

KEGG ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 16
Rings 2
Aromatic Rings 2
Rotatable Bonds 2
Van der Waals Molecular Volume 203.34
Topological Polar Surface Area 40.46
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
logP 3.27
Molar Refractivity 65.14

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Created at
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Updated at
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