trimethyl(pyren-1-yloxy)silane

C19H18OSi — CID 14009442

IUPACtrimethyl(pyren-1-yloxy)silane
SMILESC[Si](C)(C)Oc1ccc2ccc3cccc4ccc1c2c34
InChIInChI=1S/C19H18OSi/c1-21(2,3)20-17-12-10-15-8-7-13-5-4-6-14-9-11-16(17)19(15)18(13)14/h4-12H,1-3H3
InChIKeyJUPQXMBZFLATDZ-UHFFFAOYSA-N
MW290.44 g/mol
LogP5.80
Rot. Bonds2

About trimethyl(pyren-1-yloxy)silane

trimethyl(pyren-1-yloxy)silane (PubChem CID 14009442) has the molecular formula C19H18OSi and a molecular weight of 290.44 g/mol. Its IUPAC name is trimethyl(pyren-1-yloxy)silane.

Molecular Properties

Compound Nametrimethyl(pyren-1-yloxy)silane
PubChem CID14009442
Molecular FormulaC19H18OSi
Molecular Weight290.44 g/mol
Exact Mass290.11
IUPAC Nametrimethyl(pyren-1-yloxy)silane
SMILESC[Si](C)(C)Oc1ccc2ccc3cccc4ccc1c2c34
InChIInChI=1S/C19H18OSi/c1-21(2,3)20-17-12-10-15-8-7-13-5-4-6-14-9-11-16(17)19(15)18(13)14/h4-12H,1-3H3
InChIKeyJUPQXMBZFLATDZ-UHFFFAOYSA-N
XLogP5.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.44
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[1-(2-trimethylsilyloxynaphthalen-1-yl)naphthalen-2-yl]oxysilane
CID 53486788
(1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane
CID 132579889
tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxy-8-chloronaphthalen-2-yl]oxy-dimethylsilane
CID 15437908
1,8-di(pyren-1-yl)pyrene
CID 58915622
CID 175833725
CID 175833725
diethoxy-methyl-pyren-1-ylsilane
CID 90259793
5,12,19-trimethoxy-6,13,20-tri(pyren-1-yloxy)tetracyclo[15.4.0.03,8.010,15]henicosa-1(21),3,5,7,10,12,14,17,19-nonaene
CID 102312197
trimethyl-(2-methyl-3-trimethylsilyloxyphenoxy)silane
CID 14647908
acetaldehyde;methoxymethane;1-methoxypyrene;pyren-1-ol
CID 162172917
pyren-1-yl pentanoate
CID 174878717
oxo(pyren-1-yl)phosphanium
CID 154139742
3-perylen-3-yloxyperylene
CID 174459664

Frequently Asked Questions

What is the IUPAC name of trimethyl(pyren-1-yloxy)silane?
The IUPAC name of trimethyl(pyren-1-yloxy)silane (CID 14009442) is trimethyl(pyren-1-yloxy)silane.
What is the SMILES notation for trimethyl(pyren-1-yloxy)silane?
The canonical SMILES for trimethyl(pyren-1-yloxy)silane is C[Si](C)(C)Oc1ccc2ccc3cccc4ccc1c2c34.
What is the InChIKey of trimethyl(pyren-1-yloxy)silane?
The InChIKey is JUPQXMBZFLATDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18OSi/c1-21(2,3)20-17-12-10-15-8-7-13-5-4-6-14-9-11-16(17)19(15)18(13)14/h4-12H,1-3H3.
What are the key properties of trimethyl(pyren-1-yloxy)silane?
trimethyl(pyren-1-yloxy)silane has a molecular weight of 290.44 g/mol, XLogP of 5.80, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(pyren-1-yloxy)silane is sourced from PubChem (CID 14009442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).