CID 20789481

C8H11Si — CID 20789481

IUPAC—
SMILES[Si]CC1CC2C=CC1C2
InChIInChI=1S/C8H11Si/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-5H2
InChIKeySIYCNRRBLVFPGD-UHFFFAOYSA-N
MW135.26 g/mol
LogP1.79
Rot. Bonds1

About CID 20789481

CID 20789481 (PubChem CID 20789481) has the molecular formula C8H11Si and a molecular weight of 135.26 g/mol.

Molecular Properties

Compound NameCID 20789481
PubChem CID20789481
Molecular FormulaC8H11Si
Molecular Weight135.26 g/mol
Exact Mass135.06
IUPAC Name—
SMILES[Si]CC1CC2C=CC1C2
InChIInChI=1S/C8H11Si/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-5H2
InChIKeySIYCNRRBLVFPGD-UHFFFAOYSA-N
XLogP1.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.26
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 20789481?
The IUPAC name of CID 20789481 (CID 20789481) is not available.
What is the SMILES notation for CID 20789481?
The canonical SMILES for CID 20789481 is [Si]CC1CC2C=CC1C2.
What is the InChIKey of CID 20789481?
The InChIKey is SIYCNRRBLVFPGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11Si/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-5H2.
What are the key properties of CID 20789481?
CID 20789481 has a molecular weight of 135.26 g/mol, XLogP of 1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20789481 is sourced from PubChem (CID 20789481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).