6-(2-hydroxyazulen-6-yl)azulen-2-ol

C20H14O2 — CID 21063093

IUPAC6-(2-hydroxyazulen-6-yl)azulen-2-ol
SMILESOc1cc2ccc(-c3ccc4cc(O)cc-4cc3)ccc-2c1
InChIInChI=1S/C20H14O2/c21-19-9-15-5-1-13(2-6-16(15)10-19)14-3-7-17-11-20(22)12-18(17)8-4-14/h1-12,21-22H
InChIKeyHXGUHHAVWPTALD-UHFFFAOYSA-N
MW286.33 g/mol
LogP4.97
Rot. Bonds1

About 6-(2-hydroxyazulen-6-yl)azulen-2-ol

6-(2-hydroxyazulen-6-yl)azulen-2-ol (PubChem CID 21063093) has the molecular formula C20H14O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 6-(2-hydroxyazulen-6-yl)azulen-2-ol.

Molecular Properties

Compound Name6-(2-hydroxyazulen-6-yl)azulen-2-ol
PubChem CID21063093
Molecular FormulaC20H14O2
Molecular Weight286.33 g/mol
Exact Mass286.10
IUPAC Name6-(2-hydroxyazulen-6-yl)azulen-2-ol
SMILESOc1cc2ccc(-c3ccc4cc(O)cc-4cc3)ccc-2c1
InChIInChI=1S/C20H14O2/c21-19-9-15-5-1-13(2-6-16(15)10-19)14-3-7-17-11-20(22)12-18(17)8-4-14/h1-12,21-22H
InChIKeyHXGUHHAVWPTALD-UHFFFAOYSA-N
XLogP4.97
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyazulen-6-yl)azulen-2-ol?
The IUPAC name of 6-(2-hydroxyazulen-6-yl)azulen-2-ol (CID 21063093) is 6-(2-hydroxyazulen-6-yl)azulen-2-ol.
What is the SMILES notation for 6-(2-hydroxyazulen-6-yl)azulen-2-ol?
The canonical SMILES for 6-(2-hydroxyazulen-6-yl)azulen-2-ol is Oc1cc2ccc(-c3ccc4cc(O)cc-4cc3)ccc-2c1.
What is the InChIKey of 6-(2-hydroxyazulen-6-yl)azulen-2-ol?
The InChIKey is HXGUHHAVWPTALD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14O2/c21-19-9-15-5-1-13(2-6-16(15)10-19)14-3-7-17-11-20(22)12-18(17)8-4-14/h1-12,21-22H.
What are the key properties of 6-(2-hydroxyazulen-6-yl)azulen-2-ol?
6-(2-hydroxyazulen-6-yl)azulen-2-ol has a molecular weight of 286.33 g/mol, XLogP of 4.97, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyazulen-6-yl)azulen-2-ol is sourced from PubChem (CID 21063093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).