4-(3-ethyloxetan-3-yl)butylsilane

C9H20OSi — CID 174117398

IUPAC4-(3-ethyloxetan-3-yl)butylsilane
SMILESCCC1(CCCC[SiH3])COC1
InChIInChI=1S/C9H20OSi/c1-2-9(7-10-8-9)5-3-4-6-11/h2-8H2,1,11H3
InChIKeyDHFVIWLVNCMMJT-UHFFFAOYSA-N
MW172.34 g/mol
LogP1.37
Rot. Bonds5

About 4-(3-ethyloxetan-3-yl)butylsilane

4-(3-ethyloxetan-3-yl)butylsilane (PubChem CID 174117398) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is 4-(3-ethyloxetan-3-yl)butylsilane.

Molecular Properties

Compound Name4-(3-ethyloxetan-3-yl)butylsilane
PubChem CID174117398
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name4-(3-ethyloxetan-3-yl)butylsilane
SMILESCCC1(CCCC[SiH3])COC1
InChIInChI=1S/C9H20OSi/c1-2-9(7-10-8-9)5-3-4-6-11/h2-8H2,1,11H3
InChIKeyDHFVIWLVNCMMJT-UHFFFAOYSA-N
XLogP1.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(3-ethyloxetan-3-yl)butylsilane?
The IUPAC name of 4-(3-ethyloxetan-3-yl)butylsilane (CID 174117398) is 4-(3-ethyloxetan-3-yl)butylsilane.
What is the SMILES notation for 4-(3-ethyloxetan-3-yl)butylsilane?
The canonical SMILES for 4-(3-ethyloxetan-3-yl)butylsilane is CCC1(CCCC[SiH3])COC1.
What is the InChIKey of 4-(3-ethyloxetan-3-yl)butylsilane?
The InChIKey is DHFVIWLVNCMMJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSi/c1-2-9(7-10-8-9)5-3-4-6-11/h2-8H2,1,11H3.
What are the key properties of 4-(3-ethyloxetan-3-yl)butylsilane?
4-(3-ethyloxetan-3-yl)butylsilane has a molecular weight of 172.34 g/mol, XLogP of 1.37, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethyloxetan-3-yl)butylsilane is sourced from PubChem (CID 174117398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).