1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol

C20H14O4 — CID 11415880

IUPAC1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol
SMILESOc1ccc2ccc(O)c(-c3c(O)ccc4ccc(O)cc34)c2c1
InChIInChI=1S/C20H14O4/c21-13-5-1-11-3-7-17(23)19(15(11)9-13)20-16-10-14(22)6-2-12(16)4-8-18(20)24/h1-10,21-24H
InChIKeyFUXWXKZEFOPVKY-UHFFFAOYSA-N
MW318.33 g/mol
LogP4.48
Rot. Bonds1

About 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol

1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol (PubChem CID 11415880) has the molecular formula C20H14O4 and a molecular weight of 318.33 g/mol. Its IUPAC name is 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol.

Molecular Properties

Compound Name1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol
PubChem CID11415880
Molecular FormulaC20H14O4
Molecular Weight318.33 g/mol
Exact Mass318.09
IUPAC Name1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol
SMILESOc1ccc2ccc(O)c(-c3c(O)ccc4ccc(O)cc34)c2c1
InChIInChI=1S/C20H14O4/c21-13-5-1-11-3-7-17(23)19(15(11)9-13)20-16-10-14(22)6-2-12(16)4-8-18(20)24/h1-10,21-24H
InChIKeyFUXWXKZEFOPVKY-UHFFFAOYSA-N
XLogP4.48
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.33
LogP ≤ 54.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,5-dihydroxyphenyl)naphthalene-2,7-diol
CID 121311364
1-phenylnaphthalene-2,7-diol
CID 118054370
1-(2,7-dihydroxynaphthalen-1-yl)oxynaphthalene-2,7-diol
CID 146469077
7-bromo-1-(7-bromo-2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 11189978
1-(3-amino-1,2-oxazol-5-yl)naphthalene-2,7-diol
CID 136952337
10,13,16-trioxapentacyclo[15.6.2.26,9.02,7.020,24]heptacosa-1(23),2,4,6,8,17(25),18,20(24),21,26-decaene-3,23-diol
CID 10992731
phenanthren-3-ol
CID 73057263
5,6,7,8-tetraethyl-1-(5,6,7,8-tetraethyl-2-hydroxyanthracen-1-yl)anthracen-2-ol
CID 102103016
1-(2-aminopropan-2-yl)naphthalene-2,7-diol
CID 117309315
naphthalene-1,4-diol;naphthalene-2,6-diol
CID 67516588
1-[2-(2,7-dihydroxynaphthalen-1-yl)butan-2-yl]naphthalene-2,7-diol
CID 23054353
7-amino-8-phenylnaphthalen-2-ol
CID 115057649

Frequently Asked Questions

What is the IUPAC name of 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol?
The IUPAC name of 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol (CID 11415880) is 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol.
What is the SMILES notation for 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol?
The canonical SMILES for 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol is Oc1ccc2ccc(O)c(-c3c(O)ccc4ccc(O)cc34)c2c1.
What is the InChIKey of 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol?
The InChIKey is FUXWXKZEFOPVKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14O4/c21-13-5-1-11-3-7-17(23)19(15(11)9-13)20-16-10-14(22)6-2-12(16)4-8-18(20)24/h1-10,21-24H.
What are the key properties of 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol?
1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol has a molecular weight of 318.33 g/mol, XLogP of 4.48, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,7-dihydroxynaphthalen-1-yl)naphthalene-2,7-diol is sourced from PubChem (CID 11415880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).