tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol

C36H34O2Si — CID 175202561

IUPACtert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
SMILESCC(C)(C)[SiH](c1ccccc1)c1ccccc1.Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12
InChIInChI=1S/C20H14O2.C16H20Si/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;1-16(2,3)17(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h1-12,21-22H;4-13,17H,1-3H3
InChIKeyYCAHVTDYIUDVRH-UHFFFAOYSA-N
MW526.75 g/mol
LogP7.90
Rot. Bonds3

About tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol

tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol (PubChem CID 175202561) has the molecular formula C36H34O2Si and a molecular weight of 526.75 g/mol. Its IUPAC name is tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol.

Molecular Properties

Compound Nametert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
PubChem CID175202561
Molecular FormulaC36H34O2Si
Molecular Weight526.75 g/mol
Exact Mass526.23
IUPAC Nametert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
SMILESCC(C)(C)[SiH](c1ccccc1)c1ccccc1.Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12
InChIInChI=1S/C20H14O2.C16H20Si/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;1-16(2,3)17(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h1-12,21-22H;4-13,17H,1-3H3
InChIKeyYCAHVTDYIUDVRH-UHFFFAOYSA-N
XLogP7.90
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500526.75
LogP ≤ 57.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);phosphorous acid
CID 173338729
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
bis(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);bis(propan-2-ol);titanium;hydrate
CID 11764266
cyanic acid;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 70289333
2-[(R)-tert-butylsulfinyl]sulfanyl-2-methylpropane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 11443023
chromium;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;prop-1-ene
CID 10785807
1-(2-diethylphosphorylnaphthalen-1-yl)naphthalen-2-ol
CID 102399892
1-[2-(2-hydroxynaphthalen-1-yl)propan-2-yl]naphthalen-2-ol
CID 13354439
1-[2-[ethyl(phenyl)phosphanyl]naphthalen-1-yl]naphthalen-2-ol
CID 102477574

Frequently Asked Questions

What is the IUPAC name of tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol?
The IUPAC name of tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol (CID 175202561) is tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol.
What is the SMILES notation for tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol?
The canonical SMILES for tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol is CC(C)(C)[SiH](c1ccccc1)c1ccccc1.Oc1ccc2ccccc2c1-c1c(O)ccc2ccccc12.
What is the InChIKey of tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol?
The InChIKey is YCAHVTDYIUDVRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14O2.C16H20Si/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;1-16(2,3)17(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h1-12,21-22H;4-13,17H,1-3H3.
What are the key properties of tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol?
tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol has a molecular weight of 526.75 g/mol, XLogP of 7.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl(diphenyl)silane;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol is sourced from PubChem (CID 175202561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).