1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane

C14H28O2Si — CID 139996962

IUPAC1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane
SMILESCCO[Si](C)(CC1CC1)OC(C)C1CCCC1
InChIInChI=1S/C14H28O2Si/c1-4-15-17(3,11-13-9-10-13)16-12(2)14-7-5-6-8-14/h12-14H,4-11H2,1-3H3
InChIKeyXIPKMXZQQYMZAN-UHFFFAOYSA-N
MW256.46 g/mol
LogP4.10
Rot. Bonds7

About 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane

1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane (PubChem CID 139996962) has the molecular formula C14H28O2Si and a molecular weight of 256.46 g/mol. Its IUPAC name is 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane.

Molecular Properties

Compound Name1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane
PubChem CID139996962
Molecular FormulaC14H28O2Si
Molecular Weight256.46 g/mol
Exact Mass256.19
IUPAC Name1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane
SMILESCCO[Si](C)(CC1CC1)OC(C)C1CCCC1
InChIInChI=1S/C14H28O2Si/c1-4-15-17(3,11-13-9-10-13)16-12(2)14-7-5-6-8-14/h12-14H,4-11H2,1-3H3
InChIKeyXIPKMXZQQYMZAN-UHFFFAOYSA-N
XLogP4.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.46
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane?
The IUPAC name of 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane (CID 139996962) is 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane.
What is the SMILES notation for 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane?
The canonical SMILES for 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane is CCO[Si](C)(CC1CC1)OC(C)C1CCCC1.
What is the InChIKey of 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane?
The InChIKey is XIPKMXZQQYMZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-4-15-17(3,11-13-9-10-13)16-12(2)14-7-5-6-8-14/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane?
1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane has a molecular weight of 256.46 g/mol, XLogP of 4.10, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane is sourced from PubChem (CID 139996962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).