(2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane

C12H26O2Si — CID 156790014

IUPAC(2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane
SMILESCCCCC1CC1(OCC)O[Si](C)(C)C
InChIInChI=1S/C12H26O2Si/c1-6-8-9-11-10-12(11,13-7-2)14-15(3,4)5/h11H,6-10H2,1-5H3
InChIKeyYWODMFZYGDNWBX-UHFFFAOYSA-N
MW230.42 g/mol
LogP3.78
Rot. Bonds7

About (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane

(2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane (PubChem CID 156790014) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane.

Molecular Properties

Compound Name(2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane
PubChem CID156790014
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name(2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane
SMILESCCCCC1CC1(OCC)O[Si](C)(C)C
InChIInChI=1S/C12H26O2Si/c1-6-8-9-11-10-12(11,13-7-2)14-15(3,4)5/h11H,6-10H2,1-5H3
InChIKeyYWODMFZYGDNWBX-UHFFFAOYSA-N
XLogP3.78
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane?
The IUPAC name of (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane (CID 156790014) is (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane.
What is the SMILES notation for (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane?
The canonical SMILES for (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane is CCCCC1CC1(OCC)O[Si](C)(C)C.
What is the InChIKey of (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane?
The InChIKey is YWODMFZYGDNWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-6-8-9-11-10-12(11,13-7-2)14-15(3,4)5/h11H,6-10H2,1-5H3.
What are the key properties of (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane?
(2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane has a molecular weight of 230.42 g/mol, XLogP of 3.78, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-butyl-1-ethoxycyclopropyl)oxy-trimethylsilane is sourced from PubChem (CID 156790014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).