(2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane

C9H16O2Si — CID 174274467

IUPAC(2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane
SMILESCO[SiH](OC)C1=C(C)C=C(C)C1
InChIInChI=1S/C9H16O2Si/c1-7-5-8(2)9(6-7)12(10-3)11-4/h5,12H,6H2,1-4H3
InChIKeyAWMVEAUAFHANTH-UHFFFAOYSA-N
MW184.31 g/mol
LogP1.71
Rot. Bonds3

About (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane

(2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane (PubChem CID 174274467) has the molecular formula C9H16O2Si and a molecular weight of 184.31 g/mol. Its IUPAC name is (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane.

Molecular Properties

Compound Name(2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane
PubChem CID174274467
Molecular FormulaC9H16O2Si
Molecular Weight184.31 g/mol
Exact Mass184.09
IUPAC Name(2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane
SMILESCO[SiH](OC)C1=C(C)C=C(C)C1
InChIInChI=1S/C9H16O2Si/c1-7-5-8(2)9(6-7)12(10-3)11-4/h5,12H,6H2,1-4H3
InChIKeyAWMVEAUAFHANTH-UHFFFAOYSA-N
XLogP1.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.31
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane?
The IUPAC name of (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane (CID 174274467) is (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane.
What is the SMILES notation for (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane?
The canonical SMILES for (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane is CO[SiH](OC)C1=C(C)C=C(C)C1.
What is the InChIKey of (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane?
The InChIKey is AWMVEAUAFHANTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2Si/c1-7-5-8(2)9(6-7)12(10-3)11-4/h5,12H,6H2,1-4H3.
What are the key properties of (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane?
(2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane has a molecular weight of 184.31 g/mol, XLogP of 1.71, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylcyclopenta-1,3-dien-1-yl)-dimethoxysilane is sourced from PubChem (CID 174274467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).