2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane

C12H26O2Si — CID 22141454

IUPAC2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane
SMILESCCC1CCCC(C(C)C)[Si]1(OC)OC
InChIInChI=1S/C12H26O2Si/c1-6-11-8-7-9-12(10(2)3)15(11,13-4)14-5/h10-12H,6-9H2,1-5H3
InChIKeyLVQGGLMEJKZFII-UHFFFAOYSA-N
MW230.42 g/mol
LogP3.71
Rot. Bonds4

About 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane

2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane (PubChem CID 22141454) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane.

Molecular Properties

Compound Name2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane
PubChem CID22141454
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane
SMILESCCC1CCCC(C(C)C)[Si]1(OC)OC
InChIInChI=1S/C12H26O2Si/c1-6-11-8-7-9-12(10(2)3)15(11,13-4)14-5/h10-12H,6-9H2,1-5H3
InChIKeyLVQGGLMEJKZFII-UHFFFAOYSA-N
XLogP3.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.71
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-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane?
The IUPAC name of 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane (CID 22141454) is 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane.
What is the SMILES notation for 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane?
The canonical SMILES for 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane is CCC1CCCC(C(C)C)[Si]1(OC)OC.
What is the InChIKey of 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane?
The InChIKey is LVQGGLMEJKZFII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-6-11-8-7-9-12(10(2)3)15(11,13-4)14-5/h10-12H,6-9H2,1-5H3.
What are the key properties of 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane?
2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane has a molecular weight of 230.42 g/mol, XLogP of 3.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,1-dimethoxy-6-propan-2-ylsilinane is sourced from PubChem (CID 22141454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).