CID 153327387

C8H16O2Si — CID 153327387

IUPAC—
SMILESCC(C)=C[Si]OOC(C)(C)C
InChIInChI=1S/C8H16O2Si/c1-7(2)6-11-10-9-8(3,4)5/h6H,1-5H3
InChIKeyFTLWVCJBUIMHEF-UHFFFAOYSA-N
MW172.30 g/mol
LogP2.28
Rot. Bonds3

About CID 153327387

CID 153327387 (PubChem CID 153327387) has the molecular formula C8H16O2Si and a molecular weight of 172.30 g/mol.

Molecular Properties

Compound NameCID 153327387
PubChem CID153327387
Molecular FormulaC8H16O2Si
Molecular Weight172.30 g/mol
Exact Mass172.09
IUPAC Name—
SMILESCC(C)=C[Si]OOC(C)(C)C
InChIInChI=1S/C8H16O2Si/c1-7(2)6-11-10-9-8(3,4)5/h6H,1-5H3
InChIKeyFTLWVCJBUIMHEF-UHFFFAOYSA-N
XLogP2.28
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.30
LogP ≤ 52.28
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 153327387?
The IUPAC name of CID 153327387 (CID 153327387) is not available.
What is the SMILES notation for CID 153327387?
The canonical SMILES for CID 153327387 is CC(C)=C[Si]OOC(C)(C)C.
What is the InChIKey of CID 153327387?
The InChIKey is FTLWVCJBUIMHEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2Si/c1-7(2)6-11-10-9-8(3,4)5/h6H,1-5H3.
What are the key properties of CID 153327387?
CID 153327387 has a molecular weight of 172.30 g/mol, XLogP of 2.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153327387 is sourced from PubChem (CID 153327387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).