2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane

C12H26OSi — CID 175358624

IUPAC2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane
SMILESCC(C)C1(C(C)C)CCC[Si](C)(C)O1
InChIInChI=1S/C12H26OSi/c1-10(2)12(11(3)4)8-7-9-14(5,6)13-12/h10-11H,7-9H2,1-6H3
InChIKeyPDYIQJJZIXDDHS-UHFFFAOYSA-N
MW214.42 g/mol
LogP4.05
Rot. Bonds2

About 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane

2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane (PubChem CID 175358624) has the molecular formula C12H26OSi and a molecular weight of 214.42 g/mol. Its IUPAC name is 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane.

Molecular Properties

Compound Name2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane
PubChem CID175358624
Molecular FormulaC12H26OSi
Molecular Weight214.42 g/mol
Exact Mass214.18
IUPAC Name2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane
SMILESCC(C)C1(C(C)C)CCC[Si](C)(C)O1
InChIInChI=1S/C12H26OSi/c1-10(2)12(11(3)4)8-7-9-14(5,6)13-12/h10-11H,7-9H2,1-6H3
InChIKeyPDYIQJJZIXDDHS-UHFFFAOYSA-N
XLogP4.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.42
LogP ≤ 54.05
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 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane?
The IUPAC name of 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane (CID 175358624) is 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane.
What is the SMILES notation for 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane?
The canonical SMILES for 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane is CC(C)C1(C(C)C)CCC[Si](C)(C)O1.
What is the InChIKey of 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane?
The InChIKey is PDYIQJJZIXDDHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26OSi/c1-10(2)12(11(3)4)8-7-9-14(5,6)13-12/h10-11H,7-9H2,1-6H3.
What are the key properties of 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane?
2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane has a molecular weight of 214.42 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6,6-di(propan-2-yl)oxasilinane is sourced from PubChem (CID 175358624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).