CID 171424208

C5H10O2Si — CID 171424208

IUPAC—
SMILESC=C[Si]OCOCC
InChIInChI=1S/C5H10O2Si/c1-3-6-5-7-8-4-2/h4H,2-3,5H2,1H3
InChIKeyCDKUNQDBRQLMRZ-UHFFFAOYSA-N
MW130.22 g/mol
LogP0.76
Rot. Bonds5

About CID 171424208

CID 171424208 (PubChem CID 171424208) has the molecular formula C5H10O2Si and a molecular weight of 130.22 g/mol.

Molecular Properties

Compound NameCID 171424208
PubChem CID171424208
Molecular FormulaC5H10O2Si
Molecular Weight130.22 g/mol
Exact Mass130.05
IUPAC Name—
SMILESC=C[Si]OCOCC
InChIInChI=1S/C5H10O2Si/c1-3-6-5-7-8-4-2/h4H,2-3,5H2,1H3
InChIKeyCDKUNQDBRQLMRZ-UHFFFAOYSA-N
XLogP0.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.22
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 CID 171424208?
The IUPAC name of CID 171424208 (CID 171424208) is not available.
What is the SMILES notation for CID 171424208?
The canonical SMILES for CID 171424208 is C=C[Si]OCOCC.
What is the InChIKey of CID 171424208?
The InChIKey is CDKUNQDBRQLMRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O2Si/c1-3-6-5-7-8-4-2/h4H,2-3,5H2,1H3.
What are the key properties of CID 171424208?
CID 171424208 has a molecular weight of 130.22 g/mol, XLogP of 0.76, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 171424208 is sourced from PubChem (CID 171424208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).