Structure Database (LMSD)

Common Name
4,4'-dihydroxybibenzyl
Systematic Name
Synonyms
  • 4,4'-(1,2-ethanediyl)bisphenol
LM ID
LMPK13090042
Formula
Exact Mass
Calculate m/z
214.09938
Status
Active

Classification

String Representations

InChiKey (Click to copy)
URFNSYWAGGETFK-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C14H14O2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10,15-16H,1-2H2
SMILES (Click to copy)
C1(O)=CC=C(CCC2=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 3
Van der Waals Molecular Volume 205.98
Topological Polar Surface Area 40.46
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
logP 2.88
Molar Refractivity 63.62

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Created at
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Updated at
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