CID 123494489

C5H11BOSi — CID 123494489

IUPAC—
SMILES[B][SiH2]C1CCCCO1
InChIInChI=1S/C5H11BOSi/c6-8-5-3-1-2-4-7-5/h5H,1-4,8H2
InChIKeyOXXIAUZNWBLGMJ-UHFFFAOYSA-N
MW126.04 g/mol
LogP-0.23
Rot. Bonds1

About CID 123494489

CID 123494489 (PubChem CID 123494489) has the molecular formula C5H11BOSi and a molecular weight of 126.04 g/mol.

Molecular Properties

Compound NameCID 123494489
PubChem CID123494489
Molecular FormulaC5H11BOSi
Molecular Weight126.04 g/mol
Exact Mass126.07
IUPAC Name—
SMILES[B][SiH2]C1CCCCO1
InChIInChI=1S/C5H11BOSi/c6-8-5-3-1-2-4-7-5/h5H,1-4,8H2
InChIKeyOXXIAUZNWBLGMJ-UHFFFAOYSA-N
XLogP-0.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.04
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 123494489?
The IUPAC name of CID 123494489 (CID 123494489) is not available.
What is the SMILES notation for CID 123494489?
The canonical SMILES for CID 123494489 is [B][SiH2]C1CCCCO1.
What is the InChIKey of CID 123494489?
The InChIKey is OXXIAUZNWBLGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11BOSi/c6-8-5-3-1-2-4-7-5/h5H,1-4,8H2.
What are the key properties of CID 123494489?
CID 123494489 has a molecular weight of 126.04 g/mol, XLogP of -0.23, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 123494489 is sourced from PubChem (CID 123494489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).