CID 174459765

C6H14BOSi — CID 174459765

IUPAC
SMILESC=CCO[B][Si](C)(C)C
InChIInChI=1S/C6H14BOSi/c1-5-6-8-7-9(2,3)4/h5H,1,6H2,2-4H3
InChIKeyGZIYDAGXHQZSSB-UHFFFAOYSA-N
MW141.07 g/mol
LogP1.64
Rot. Bonds4

About CID 174459765

CID 174459765 (PubChem CID 174459765) has the molecular formula C6H14BOSi and a molecular weight of 141.07 g/mol.

Molecular Properties

Compound NameCID 174459765
PubChem CID174459765
Molecular FormulaC6H14BOSi
Molecular Weight141.07 g/mol
Exact Mass141.09
IUPAC Name
SMILESC=CCO[B][Si](C)(C)C
InChIInChI=1S/C6H14BOSi/c1-5-6-8-7-9(2,3)4/h5H,1,6H2,2-4H3
InChIKeyGZIYDAGXHQZSSB-UHFFFAOYSA-N
XLogP1.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.07
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 174459765?
The IUPAC name of CID 174459765 (CID 174459765) is not available.
What is the SMILES notation for CID 174459765?
The canonical SMILES for CID 174459765 is C=CCO[B][Si](C)(C)C.
What is the InChIKey of CID 174459765?
The InChIKey is GZIYDAGXHQZSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14BOSi/c1-5-6-8-7-9(2,3)4/h5H,1,6H2,2-4H3.
What are the key properties of CID 174459765?
CID 174459765 has a molecular weight of 141.07 g/mol, XLogP of 1.64, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174459765 is sourced from PubChem (CID 174459765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).