6-methylheptan-2-ylsilane

C8H20Si — CID 174300964

IUPAC6-methylheptan-2-ylsilane
SMILESCC(C)CCCC(C)[SiH3]
InChIInChI=1S/C8H20Si/c1-7(2)5-4-6-8(3)9/h7-8H,4-6H2,1-3,9H3
InChIKeyBOFJPDLZRRTXLH-UHFFFAOYSA-N
MW144.33 g/mol
LogP1.99
Rot. Bonds4

About 6-methylheptan-2-ylsilane

6-methylheptan-2-ylsilane (PubChem CID 174300964) has the molecular formula C8H20Si and a molecular weight of 144.33 g/mol. Its IUPAC name is 6-methylheptan-2-ylsilane.

Molecular Properties

Compound Name6-methylheptan-2-ylsilane
PubChem CID174300964
Molecular FormulaC8H20Si
Molecular Weight144.33 g/mol
Exact Mass144.13
IUPAC Name6-methylheptan-2-ylsilane
SMILESCC(C)CCCC(C)[SiH3]
InChIInChI=1S/C8H20Si/c1-7(2)5-4-6-8(3)9/h7-8H,4-6H2,1-3,9H3
InChIKeyBOFJPDLZRRTXLH-UHFFFAOYSA-N
XLogP1.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.33
LogP ≤ 51.99
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 6-methylheptan-2-ylsilane?
The IUPAC name of 6-methylheptan-2-ylsilane (CID 174300964) is 6-methylheptan-2-ylsilane.
What is the SMILES notation for 6-methylheptan-2-ylsilane?
The canonical SMILES for 6-methylheptan-2-ylsilane is CC(C)CCCC(C)[SiH3].
What is the InChIKey of 6-methylheptan-2-ylsilane?
The InChIKey is BOFJPDLZRRTXLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20Si/c1-7(2)5-4-6-8(3)9/h7-8H,4-6H2,1-3,9H3.
What are the key properties of 6-methylheptan-2-ylsilane?
6-methylheptan-2-ylsilane has a molecular weight of 144.33 g/mol, XLogP of 1.99, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylheptan-2-ylsilane is sourced from PubChem (CID 174300964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).