CID 134963863

C3H4BSi — CID 134963863

IUPAC—
SMILES[B][C@@H]([Si])C=C
InChIInChI=1S/C3H4BSi/c1-2-3(4)5/h2-3H,1H2/t3-/m0/s1
InChIKeyMFDOIEPGXPGPHI-VKHMYHEASA-N
MW78.96 g/mol
LogP0.26
Rot. Bonds1

About CID 134963863

CID 134963863 (PubChem CID 134963863) has the molecular formula C3H4BSi and a molecular weight of 78.96 g/mol.

Molecular Properties

Compound NameCID 134963863
PubChem CID134963863
Molecular FormulaC3H4BSi
Molecular Weight78.96 g/mol
Exact Mass79.02
IUPAC Name—
SMILES[B][C@@H]([Si])C=C
InChIInChI=1S/C3H4BSi/c1-2-3(4)5/h2-3H,1H2/t3-/m0/s1
InChIKeyMFDOIEPGXPGPHI-VKHMYHEASA-N
XLogP0.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50078.96
LogP ≤ 50.26
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 134963863?
The IUPAC name of CID 134963863 (CID 134963863) is not available.
What is the SMILES notation for CID 134963863?
The canonical SMILES for CID 134963863 is [B][C@@H]([Si])C=C.
What is the InChIKey of CID 134963863?
The InChIKey is MFDOIEPGXPGPHI-VKHMYHEASA-N. The full InChI is InChI=1S/C3H4BSi/c1-2-3(4)5/h2-3H,1H2/t3-/m0/s1.
What are the key properties of CID 134963863?
CID 134963863 has a molecular weight of 78.96 g/mol, XLogP of 0.26, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134963863 is sourced from PubChem (CID 134963863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).