CID 20565015

C6H8O2Si — CID 20565015

IUPAC—
SMILESC[Si]OC1=CCCC1=O
InChIInChI=1S/C6H8O2Si/c1-9-8-6-4-2-3-5(6)7/h4H,2-3H2,1H3
InChIKeyGNFXVLUDQUUHFT-UHFFFAOYSA-N
MW140.21 g/mol
LogP0.92
Rot. Bonds2

About CID 20565015

CID 20565015 (PubChem CID 20565015) has the molecular formula C6H8O2Si and a molecular weight of 140.21 g/mol.

Molecular Properties

Compound NameCID 20565015
PubChem CID20565015
Molecular FormulaC6H8O2Si
Molecular Weight140.21 g/mol
Exact Mass140.03
IUPAC Name—
SMILESC[Si]OC1=CCCC1=O
InChIInChI=1S/C6H8O2Si/c1-9-8-6-4-2-3-5(6)7/h4H,2-3H2,1H3
InChIKeyGNFXVLUDQUUHFT-UHFFFAOYSA-N
XLogP0.92
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.21
LogP ≤ 50.92
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 CID 20565015?
The IUPAC name of CID 20565015 (CID 20565015) is not available.
What is the SMILES notation for CID 20565015?
The canonical SMILES for CID 20565015 is C[Si]OC1=CCCC1=O.
What is the InChIKey of CID 20565015?
The InChIKey is GNFXVLUDQUUHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O2Si/c1-9-8-6-4-2-3-5(6)7/h4H,2-3H2,1H3.
What are the key properties of CID 20565015?
CID 20565015 has a molecular weight of 140.21 g/mol, XLogP of 0.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20565015 is sourced from PubChem (CID 20565015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).