1-ethyl-1-(3-methylbutoxy)silinane

C12H26OSi — CID 603731

IUPAC1-ethyl-1-(3-methylbutoxy)silinane
SMILESCC[Si]1(OCCC(C)C)CCCCC1
InChIInChI=1S/C12H26OSi/c1-4-14(10-6-5-7-11-14)13-9-8-12(2)3/h12H,4-11H2,1-3H3
InChIKeyDCVHBGXACQIYJR-UHFFFAOYSA-N
MW214.42 g/mol
LogP4.20
Rot. Bonds5

About 1-ethyl-1-(3-methylbutoxy)silinane

1-ethyl-1-(3-methylbutoxy)silinane (PubChem CID 603731) has the molecular formula C12H26OSi and a molecular weight of 214.42 g/mol. Its IUPAC name is 1-ethyl-1-(3-methylbutoxy)silinane.

Molecular Properties

Compound Name1-ethyl-1-(3-methylbutoxy)silinane
PubChem CID603731
Molecular FormulaC12H26OSi
Molecular Weight214.42 g/mol
Exact Mass214.18
IUPAC Name1-ethyl-1-(3-methylbutoxy)silinane
SMILESCC[Si]1(OCCC(C)C)CCCCC1
InChIInChI=1S/C12H26OSi/c1-4-14(10-6-5-7-11-14)13-9-8-12(2)3/h12H,4-11H2,1-3H3
InChIKeyDCVHBGXACQIYJR-UHFFFAOYSA-N
XLogP4.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.42
LogP ≤ 54.20
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 1-ethyl-1-(3-methylbutoxy)silinane?
The IUPAC name of 1-ethyl-1-(3-methylbutoxy)silinane (CID 603731) is 1-ethyl-1-(3-methylbutoxy)silinane.
What is the SMILES notation for 1-ethyl-1-(3-methylbutoxy)silinane?
The canonical SMILES for 1-ethyl-1-(3-methylbutoxy)silinane is CC[Si]1(OCCC(C)C)CCCCC1.
What is the InChIKey of 1-ethyl-1-(3-methylbutoxy)silinane?
The InChIKey is DCVHBGXACQIYJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26OSi/c1-4-14(10-6-5-7-11-14)13-9-8-12(2)3/h12H,4-11H2,1-3H3.
What are the key properties of 1-ethyl-1-(3-methylbutoxy)silinane?
1-ethyl-1-(3-methylbutoxy)silinane has a molecular weight of 214.42 g/mol, XLogP of 4.20, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(3-methylbutoxy)silinane is sourced from PubChem (CID 603731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).