(2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane

C17H24OSi — CID 139784623

IUPAC(2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane
SMILESCCCC1=C([Si](C)(C)c2ccccc2OC)CC=C1
InChIInChI=1S/C17H24OSi/c1-5-9-14-10-8-13-16(14)19(3,4)17-12-7-6-11-15(17)18-2/h6-8,10-12H,5,9,13H2,1-4H3
InChIKeyZFCUOQSNGZABEC-UHFFFAOYSA-N
MW272.46 g/mol
LogP4.21
Rot. Bonds5

About (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane

(2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane (PubChem CID 139784623) has the molecular formula C17H24OSi and a molecular weight of 272.46 g/mol. Its IUPAC name is (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane.

Molecular Properties

Compound Name(2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane
PubChem CID139784623
Molecular FormulaC17H24OSi
Molecular Weight272.46 g/mol
Exact Mass272.16
IUPAC Name(2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane
SMILESCCCC1=C([Si](C)(C)c2ccccc2OC)CC=C1
InChIInChI=1S/C17H24OSi/c1-5-9-14-10-8-13-16(14)19(3,4)17-12-7-6-11-15(17)18-2/h6-8,10-12H,5,9,13H2,1-4H3
InChIKeyZFCUOQSNGZABEC-UHFFFAOYSA-N
XLogP4.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane?
The IUPAC name of (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane (CID 139784623) is (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane.
What is the SMILES notation for (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane?
The canonical SMILES for (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane is CCCC1=C([Si](C)(C)c2ccccc2OC)CC=C1.
What is the InChIKey of (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane?
The InChIKey is ZFCUOQSNGZABEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24OSi/c1-5-9-14-10-8-13-16(14)19(3,4)17-12-7-6-11-15(17)18-2/h6-8,10-12H,5,9,13H2,1-4H3.
What are the key properties of (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane?
(2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane has a molecular weight of 272.46 g/mol, XLogP of 4.21, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl)-dimethyl-(2-propylcyclopenta-1,3-dien-1-yl)silane is sourced from PubChem (CID 139784623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).