1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane

C22H20O3 — CID 20848816

IUPAC1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
SMILESCOC.Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12
InChIInChI=1S/C20H14O2.C2H6O/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22;1-3-2/h1-12,21-22H;1-2H3
InChIKeyWJYBGGDBOOQORX-UHFFFAOYSA-N
MW332.40 g/mol
LogP5.33
Rot. Bonds1

About 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane

1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane (PubChem CID 20848816) has the molecular formula C22H20O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane.

Molecular Properties

Compound Name1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
PubChem CID20848816
Molecular FormulaC22H20O3
Molecular Weight332.40 g/mol
Exact Mass332.14
IUPAC Name1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
SMILESCOC.Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12
InChIInChI=1S/C20H14O2.C2H6O/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22;1-3-2/h1-12,21-22H;1-2H3
InChIKeyWJYBGGDBOOQORX-UHFFFAOYSA-N
XLogP5.33
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.40
LogP ≤ 55.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane?
The IUPAC name of 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane (CID 20848816) is 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane.
What is the SMILES notation for 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane?
The canonical SMILES for 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane is COC.Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12.
What is the InChIKey of 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane?
The InChIKey is WJYBGGDBOOQORX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14O2.C2H6O/c21-17-11-9-13-5-1-3-7-15(13)19(17)20-16-8-4-2-6-14(16)10-12-18(20)22;1-3-2/h1-12,21-22H;1-2H3.
What are the key properties of 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane?
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane has a molecular weight of 332.40 g/mol, XLogP of 5.33, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane is sourced from PubChem (CID 20848816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).