triethyl(pyren-2-yl)silane

C22H24Si — CID 134844118

IUPACtriethyl(pyren-2-yl)silane
SMILESCC[Si](CC)(CC)c1cc2ccc3cccc4ccc(c1)c2c34
InChIInChI=1S/C22H24Si/c1-4-23(5-2,6-3)20-14-18-12-10-16-8-7-9-17-11-13-19(15-20)22(18)21(16)17/h7-15H,4-6H2,1-3H3
InChIKeyCWJILODAPRNCQF-UHFFFAOYSA-N
MW316.52 g/mol
LogP6.30
Rot. Bonds4

About triethyl(pyren-2-yl)silane

triethyl(pyren-2-yl)silane (PubChem CID 134844118) has the molecular formula C22H24Si and a molecular weight of 316.52 g/mol. Its IUPAC name is triethyl(pyren-2-yl)silane.

Molecular Properties

Compound Nametriethyl(pyren-2-yl)silane
PubChem CID134844118
Molecular FormulaC22H24Si
Molecular Weight316.52 g/mol
Exact Mass316.16
IUPAC Nametriethyl(pyren-2-yl)silane
SMILESCC[Si](CC)(CC)c1cc2ccc3cccc4ccc(c1)c2c34
InChIInChI=1S/C22H24Si/c1-4-23(5-2,6-3)20-14-18-12-10-16-8-7-9-17-11-13-19(15-20)22(18)21(16)17/h7-15H,4-6H2,1-3H3
InChIKeyCWJILODAPRNCQF-UHFFFAOYSA-N
XLogP6.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.52
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

azane;propane;pyrene
CID 87370632
5-triethylsilylphenalene-1,3-dione
CID 134843965
trimethoxy(pyren-2-yl)silane
CID 23434774
hexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1,3(8),4,6,9,11,13,15,17(21),18,20(22)-undecaene
CID 172997689
N,N-diethylpyren-2-amine
CID 122393290
pyrene;dihydrobromide
CID 172822251
pyrene;zirconium
CID 175873743
trimethyl-(7-trimethylsilylpyren-2-yl)silane
CID 122203195
2-(4-pyren-2-ylphenyl)pyrene
CID 140856020
pyrene;1,3-xylene
CID 174892551
triethyl-(9-triethylsilylchrysen-3-yl)silane
CID 58362227
CID 174552080
CID 174552080

Frequently Asked Questions

What is the IUPAC name of triethyl(pyren-2-yl)silane?
The IUPAC name of triethyl(pyren-2-yl)silane (CID 134844118) is triethyl(pyren-2-yl)silane.
What is the SMILES notation for triethyl(pyren-2-yl)silane?
The canonical SMILES for triethyl(pyren-2-yl)silane is CC[Si](CC)(CC)c1cc2ccc3cccc4ccc(c1)c2c34.
What is the InChIKey of triethyl(pyren-2-yl)silane?
The InChIKey is CWJILODAPRNCQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24Si/c1-4-23(5-2,6-3)20-14-18-12-10-16-8-7-9-17-11-13-19(15-20)22(18)21(16)17/h7-15H,4-6H2,1-3H3.
What are the key properties of triethyl(pyren-2-yl)silane?
triethyl(pyren-2-yl)silane has a molecular weight of 316.52 g/mol, XLogP of 6.30, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(pyren-2-yl)silane is sourced from PubChem (CID 134844118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).