1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol

C28H23OP — CID 102477574

IUPAC1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol
SMILESCCP(c1ccccc1)c1ccc2ccccc2c1-c1c(O)ccc2ccccc12
InChIInChI=1S/C28H23OP/c1-2-30(22-12-4-3-5-13-22)26-19-17-21-11-7-9-15-24(21)28(26)27-23-14-8-6-10-20(23)16-18-25(27)29/h3-19,29H,2H2,1H3
InChIKeyJACDOGRVZOIBTP-UHFFFAOYSA-N
MW406.47 g/mol
LogP6.82
Rot. Bonds4

About 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol

1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol (PubChem CID 102477574) has the molecular formula C28H23OP and a molecular weight of 406.47 g/mol. Its IUPAC name is 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol
PubChem CID102477574
Molecular FormulaC28H23OP
Molecular Weight406.47 g/mol
Exact Mass406.15
IUPAC Name1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol
SMILESCCP(c1ccccc1)c1ccc2ccccc2c1-c1c(O)ccc2ccccc12
InChIInChI=1S/C28H23OP/c1-2-30(22-12-4-3-5-13-22)26-19-17-21-11-7-9-15-24(21)28(26)27-23-14-8-6-10-20(23)16-18-25(27)29/h3-19,29H,2H2,1H3
InChIKeyJACDOGRVZOIBTP-UHFFFAOYSA-N
XLogP6.82
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.47
LogP ≤ 56.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);phosphorous acid
CID 173338729
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;N-methyl-N-phosphanylmethanamine
CID 142347259
tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);hexakis(propan-2-ol);titanium
CID 134903058
diphenylarsorylbenzene;gadolinium(3+);1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 11468369
[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane;ruthenium(1+);acetate
CID 21202945
1-(2-pentoxynaphthalen-1-yl)naphthalen-2-ol
CID 58560218
bis([1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane);bis(rhodium);dihydrate
CID 73162021
bis(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);bis(propan-2-ol);titanium;hydrate
CID 11764266
1-[2-[4-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxybutoxy]naphthalen-1-yl]naphthalen-2-ol
CID 12008941
cyanic acid;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 70289333
[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane
CID 21335175

Frequently Asked Questions

What is the IUPAC name of 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol?
The IUPAC name of 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol (CID 102477574) is 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol.
What is the SMILES notation for 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol?
The canonical SMILES for 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol is CCP(c1ccccc1)c1ccc2ccccc2c1-c1c(O)ccc2ccccc12.
What is the InChIKey of 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol?
The InChIKey is JACDOGRVZOIBTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23OP/c1-2-30(22-12-4-3-5-13-22)26-19-17-21-11-7-9-15-24(21)28(26)27-23-14-8-6-10-20(23)16-18-25(27)29/h3-19,29H,2H2,1H3.
What are the key properties of 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol?
1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol has a molecular weight of 406.47 g/mol, XLogP of 6.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol is sourced from PubChem (CID 102477574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).