CID 23571857

C4H12BO2Si — CID 23571857

IUPAC—
SMILESC[B][Si](C)(OC)OC
InChIInChI=1S/C4H12BO2Si/c1-5-8(4,6-2)7-3/h1-4H3
InChIKeyHPMPAYQZBFBPQO-UHFFFAOYSA-N
MW131.04 g/mol
LogP0.60
Rot. Bonds3

About CID 23571857

CID 23571857 (PubChem CID 23571857) has the molecular formula C4H12BO2Si and a molecular weight of 131.04 g/mol.

Molecular Properties

Compound NameCID 23571857
PubChem CID23571857
Molecular FormulaC4H12BO2Si
Molecular Weight131.04 g/mol
Exact Mass131.07
IUPAC Name—
SMILESC[B][Si](C)(OC)OC
InChIInChI=1S/C4H12BO2Si/c1-5-8(4,6-2)7-3/h1-4H3
InChIKeyHPMPAYQZBFBPQO-UHFFFAOYSA-N
XLogP0.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.04
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 23571857?
The IUPAC name of CID 23571857 (CID 23571857) is not available.
What is the SMILES notation for CID 23571857?
The canonical SMILES for CID 23571857 is C[B][Si](C)(OC)OC.
What is the InChIKey of CID 23571857?
The InChIKey is HPMPAYQZBFBPQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12BO2Si/c1-5-8(4,6-2)7-3/h1-4H3.
What are the key properties of CID 23571857?
CID 23571857 has a molecular weight of 131.04 g/mol, XLogP of 0.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23571857 is sourced from PubChem (CID 23571857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).