CID 57306391

C8H13Si — CID 57306391

IUPAC—
SMILESCC1=[Si]C(C)C(C)=C1C
InChIInChI=1S/C8H13Si/c1-5-6(2)8(4)9-7(5)3/h7H,1-4H3
InChIKeyOCFBOKONHMBHGO-UHFFFAOYSA-N
MW137.28 g/mol
LogP2.04
Rot. Bonds

About CID 57306391

CID 57306391 (PubChem CID 57306391) has the molecular formula C8H13Si and a molecular weight of 137.28 g/mol.

Molecular Properties

Compound NameCID 57306391
PubChem CID57306391
Molecular FormulaC8H13Si
Molecular Weight137.28 g/mol
Exact Mass137.08
IUPAC Name—
SMILESCC1=[Si]C(C)C(C)=C1C
InChIInChI=1S/C8H13Si/c1-5-6(2)8(4)9-7(5)3/h7H,1-4H3
InChIKeyOCFBOKONHMBHGO-UHFFFAOYSA-N
XLogP2.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.28
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 57306391?
The IUPAC name of CID 57306391 (CID 57306391) is not available.
What is the SMILES notation for CID 57306391?
The canonical SMILES for CID 57306391 is CC1=[Si]C(C)C(C)=C1C.
What is the InChIKey of CID 57306391?
The InChIKey is OCFBOKONHMBHGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13Si/c1-5-6(2)8(4)9-7(5)3/h7H,1-4H3.
What are the key properties of CID 57306391?
CID 57306391 has a molecular weight of 137.28 g/mol, XLogP of 2.04, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57306391 is sourced from PubChem (CID 57306391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).