cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium

C26H24O4P+ — CID 177467379

IUPACcyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium
SMILESO=[P+](Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12)OC1CCCCC1
InChIInChI=1S/C26H23O4P/c27-23-16-14-18-8-4-6-12-21(18)25(23)26-22-13-7-5-9-19(22)15-17-24(26)30-31(28)29-20-10-2-1-3-11-20/h4-9,12-17,20H,1-3,10-11H2/p+1
InChIKeyZNYDSYQORARSGN-UHFFFAOYSA-O
MW431.45 g/mol
LogP7.75
Rot. Bonds5

About cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium

cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium (PubChem CID 177467379) has the molecular formula C26H24O4P+ and a molecular weight of 431.45 g/mol. Its IUPAC name is cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium.

Molecular Properties

Compound Namecyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium
PubChem CID177467379
Molecular FormulaC26H24O4P+
Molecular Weight431.45 g/mol
Exact Mass431.14
IUPAC Namecyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium
SMILESO=[P+](Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12)OC1CCCCC1
InChIInChI=1S/C26H23O4P/c27-23-16-14-18-8-4-6-12-21(18)25(23)26-22-13-7-5-9-19(22)15-17-24(26)30-31(28)29-20-10-2-1-3-11-20/h4-9,12-17,20H,1-3,10-11H2/p+1
InChIKeyZNYDSYQORARSGN-UHFFFAOYSA-O
XLogP7.75
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.45
LogP ≤ 57.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl] hypofluorite
CID 155278938
1-[2-[4-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxybutoxy]naphthalen-1-yl]naphthalen-2-ol
CID 12008941
[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl] dihydrogen phosphate
CID 15162418
1-(2-prop-2-enoxynaphthalen-1-yl)naphthalen-2-ol;sulfane
CID 160621443
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
1-(2-ethenoxynaphthalen-1-yl)naphthalen-2-ol
CID 22935839
tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);phosphorous acid
CID 173338729
(2-cyclohexyloxynaphthalen-1-yl)methanol
CID 43505781
1-(2-cyclohexyloxynaphthalen-1-yl)-2-(methoxymethyl)naphthalene
CID 141152735
1-[2-[(2S)-3-[bis[(2S)-2-hydroxy-3-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxypropyl]amino]-2-hydroxypropoxy]naphthalen-1-yl]naphthalen-2-ol
CID 138964583
1-(2-pentoxynaphthalen-1-yl)naphthalen-2-ol
CID 58560218
cyanic acid;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 70289333

Frequently Asked Questions

What is the IUPAC name of cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium?
The IUPAC name of cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium (CID 177467379) is cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium.
What is the SMILES notation for cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium?
The canonical SMILES for cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium is O=[P+](Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12)OC1CCCCC1.
What is the InChIKey of cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium?
The InChIKey is ZNYDSYQORARSGN-UHFFFAOYSA-O. The full InChI is InChI=1S/C26H23O4P/c27-23-16-14-18-8-4-6-12-21(18)25(23)26-22-13-7-5-9-19(22)15-17-24(26)30-31(28)29-20-10-2-1-3-11-20/h4-9,12-17,20H,1-3,10-11H2/p+1.
What are the key properties of cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium?
cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium has a molecular weight of 431.45 g/mol, XLogP of 7.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyloxy-[1-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]oxy-oxophosphanium is sourced from PubChem (CID 177467379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).