1,1-di(propan-2-yl)silirane

C8H18Si — CID 140716447

IUPAC1,1-di(propan-2-yl)silirane
SMILESCC(C)[Si]1(C(C)C)CC1
InChIInChI=1S/C8H18Si/c1-7(2)9(5-6-9)8(3)4/h7-8H,5-6H2,1-4H3
InChIKeyPQAVFBLRWLMHOM-UHFFFAOYSA-N
MW142.32 g/mol
LogP3.27
Rot. Bonds2

About 1,1-di(propan-2-yl)silirane

1,1-di(propan-2-yl)silirane (PubChem CID 140716447) has the molecular formula C8H18Si and a molecular weight of 142.32 g/mol. Its IUPAC name is 1,1-di(propan-2-yl)silirane.

Molecular Properties

Compound Name1,1-di(propan-2-yl)silirane
PubChem CID140716447
Molecular FormulaC8H18Si
Molecular Weight142.32 g/mol
Exact Mass142.12
IUPAC Name1,1-di(propan-2-yl)silirane
SMILESCC(C)[Si]1(C(C)C)CC1
InChIInChI=1S/C8H18Si/c1-7(2)9(5-6-9)8(3)4/h7-8H,5-6H2,1-4H3
InChIKeyPQAVFBLRWLMHOM-UHFFFAOYSA-N
XLogP3.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.32
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 1,1-di(propan-2-yl)silirane?
The IUPAC name of 1,1-di(propan-2-yl)silirane (CID 140716447) is 1,1-di(propan-2-yl)silirane.
What is the SMILES notation for 1,1-di(propan-2-yl)silirane?
The canonical SMILES for 1,1-di(propan-2-yl)silirane is CC(C)[Si]1(C(C)C)CC1.
What is the InChIKey of 1,1-di(propan-2-yl)silirane?
The InChIKey is PQAVFBLRWLMHOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Si/c1-7(2)9(5-6-9)8(3)4/h7-8H,5-6H2,1-4H3.
What are the key properties of 1,1-di(propan-2-yl)silirane?
1,1-di(propan-2-yl)silirane has a molecular weight of 142.32 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-di(propan-2-yl)silirane is sourced from PubChem (CID 140716447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).