4aH-fluorene-2,7-diol

C13H10O2 — CID 163418296

IUPAC4aH-fluorene-2,7-diol
SMILESOC1=CC2=Cc3cc(O)ccc3C2C=C1
InChIInChI=1S/C13H10O2/c14-10-1-3-12-8(6-10)5-9-7-11(15)2-4-13(9)12/h1-7,12,14-15H
InChIKeyAGHUAVIGSQSLGZ-UHFFFAOYSA-N
MW198.22 g/mol
LogP2.88
Rot. Bonds

About 4aH-fluorene-2,7-diol

4aH-fluorene-2,7-diol (PubChem CID 163418296) has the molecular formula C13H10O2 and a molecular weight of 198.22 g/mol. Its IUPAC name is 4aH-fluorene-2,7-diol.

Molecular Properties

Compound Name4aH-fluorene-2,7-diol
PubChem CID163418296
Molecular FormulaC13H10O2
Molecular Weight198.22 g/mol
Exact Mass198.07
IUPAC Name4aH-fluorene-2,7-diol
SMILESOC1=CC2=Cc3cc(O)ccc3C2C=C1
InChIInChI=1S/C13H10O2/c14-10-1-3-12-8(6-10)5-9-7-11(15)2-4-13(9)12/h1-7,12,14-15H
InChIKeyAGHUAVIGSQSLGZ-UHFFFAOYSA-N
XLogP2.88
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 135255367
magnesium;benzene-1,3-diol;oxygen(2-)
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1-[3-(1H-inden-1-yl)phenyl]-1H-indene
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2,6-dihydroxy-1-methyl-1H-naphthalene-2-carboxylic acid
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4H-chromene-4,7-diol
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Frequently Asked Questions

What is the IUPAC name of 4aH-fluorene-2,7-diol?
The IUPAC name of 4aH-fluorene-2,7-diol (CID 163418296) is 4aH-fluorene-2,7-diol.
What is the SMILES notation for 4aH-fluorene-2,7-diol?
The canonical SMILES for 4aH-fluorene-2,7-diol is OC1=CC2=Cc3cc(O)ccc3C2C=C1.
What is the InChIKey of 4aH-fluorene-2,7-diol?
The InChIKey is AGHUAVIGSQSLGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O2/c14-10-1-3-12-8(6-10)5-9-7-11(15)2-4-13(9)12/h1-7,12,14-15H.
What are the key properties of 4aH-fluorene-2,7-diol?
4aH-fluorene-2,7-diol has a molecular weight of 198.22 g/mol, XLogP of 2.88, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4aH-fluorene-2,7-diol is sourced from PubChem (CID 163418296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).