2,2-dimethylsiletane

C5H12Si — CID 71373499

IUPAC2,2-dimethylsiletane
SMILESCC1(C)CC[SiH2]1
InChIInChI=1S/C5H12Si/c1-5(2)3-4-6-5/h3-4,6H2,1-2H3
InChIKeyHRRZTBKBJIARQR-UHFFFAOYSA-N
MW100.24 g/mol
LogP1.18
Rot. Bonds

About 2,2-dimethylsiletane

2,2-dimethylsiletane (PubChem CID 71373499) has the molecular formula C5H12Si and a molecular weight of 100.24 g/mol. Its IUPAC name is 2,2-dimethylsiletane.

Molecular Properties

Compound Name2,2-dimethylsiletane
PubChem CID71373499
Molecular FormulaC5H12Si
Molecular Weight100.24 g/mol
Exact Mass100.07
IUPAC Name2,2-dimethylsiletane
SMILESCC1(C)CC[SiH2]1
InChIInChI=1S/C5H12Si/c1-5(2)3-4-6-5/h3-4,6H2,1-2H3
InChIKeyHRRZTBKBJIARQR-UHFFFAOYSA-N
XLogP1.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.24
LogP ≤ 51.18
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 2,2-dimethylsiletane?
The IUPAC name of 2,2-dimethylsiletane (CID 71373499) is 2,2-dimethylsiletane.
What is the SMILES notation for 2,2-dimethylsiletane?
The canonical SMILES for 2,2-dimethylsiletane is CC1(C)CC[SiH2]1.
What is the InChIKey of 2,2-dimethylsiletane?
The InChIKey is HRRZTBKBJIARQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12Si/c1-5(2)3-4-6-5/h3-4,6H2,1-2H3.
What are the key properties of 2,2-dimethylsiletane?
2,2-dimethylsiletane has a molecular weight of 100.24 g/mol, XLogP of 1.18, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylsiletane is sourced from PubChem (CID 71373499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).