1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol

C27H20O2 — CID 58219531

IUPAC1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol
SMILESCc1cc2cc(-c3ccccc3)ccc2c(-c2c(O)ccc3ccccc23)c1O
InChIInChI=1S/C27H20O2/c1-17-15-21-16-20(18-7-3-2-4-8-18)11-13-23(21)26(27(17)29)25-22-10-6-5-9-19(22)12-14-24(25)28/h2-16,28-29H,1H3
InChIKeySIFXAQZLTKFFLU-UHFFFAOYSA-N
MW376.46 g/mol
LogP7.05
Rot. Bonds2

About 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol

1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol (PubChem CID 58219531) has the molecular formula C27H20O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol.

Molecular Properties

Compound Name1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol
PubChem CID58219531
Molecular FormulaC27H20O2
Molecular Weight376.46 g/mol
Exact Mass376.15
IUPAC Name1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol
SMILESCc1cc2cc(-c3ccccc3)ccc2c(-c2c(O)ccc3ccccc23)c1O
InChIInChI=1S/C27H20O2/c1-17-15-21-16-20(18-7-3-2-4-8-18)11-13-23(21)26(27(17)29)25-22-10-6-5-9-19(22)12-14-24(25)28/h2-16,28-29H,1H3
InChIKeySIFXAQZLTKFFLU-UHFFFAOYSA-N
XLogP7.05
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.46
LogP ≤ 57.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[3-methyl-1-(3-methyl-6-phenyl-2-phosphanylnaphthalen-1-yl)-6-phenylnaphthalen-2-yl]phosphane
CID 59705759
tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);hexakis(propan-2-ol);titanium
CID 134903058
1-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-ol
CID 156562288
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
bis(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);bis(propan-2-ol);titanium;hydrate
CID 11764266
ethane;3-hydroxy-4-(2-hydroxynaphthalen-1-yl)naphthalene-2-carboxylic acid
CID 160574931
3-bromo-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 101402327
3-[[3-hydroxy-4-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]methoxymethyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 10985666
2-methyl-4-(4-phenylphenyl)phenol
CID 83131251
tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);phosphorous acid
CID 173338729
3-methyl-2-phenylnaphthalen-1-ol
CID 68536757
[3-hydroxy-4-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-(4-methylphenyl)methanone
CID 18720381

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol?
The IUPAC name of 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol (CID 58219531) is 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol.
What is the SMILES notation for 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol?
The canonical SMILES for 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol is Cc1cc2cc(-c3ccccc3)ccc2c(-c2c(O)ccc3ccccc23)c1O.
What is the InChIKey of 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol?
The InChIKey is SIFXAQZLTKFFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20O2/c1-17-15-21-16-20(18-7-3-2-4-8-18)11-13-23(21)26(27(17)29)25-22-10-6-5-9-19(22)12-14-24(25)28/h2-16,28-29H,1H3.
What are the key properties of 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol?
1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol has a molecular weight of 376.46 g/mol, XLogP of 7.05, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxynaphthalen-1-yl)-3-methyl-6-phenylnaphthalen-2-ol is sourced from PubChem (CID 58219531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).