CID 87087119

C7H15BOSi — CID 87087119

IUPAC—
SMILES[B][Si](C)(C)C1CCCCO1
InChIInChI=1S/C7H15BOSi/c1-10(2,8)7-5-3-4-6-9-7/h7H,3-6H2,1-2H3
InChIKeyYUQQTAOSILQKEF-UHFFFAOYSA-N
MW154.09 g/mol
LogP1.47
Rot. Bonds1

About CID 87087119

CID 87087119 (PubChem CID 87087119) has the molecular formula C7H15BOSi and a molecular weight of 154.09 g/mol.

Molecular Properties

Compound NameCID 87087119
PubChem CID87087119
Molecular FormulaC7H15BOSi
Molecular Weight154.09 g/mol
Exact Mass154.10
IUPAC Name—
SMILES[B][Si](C)(C)C1CCCCO1
InChIInChI=1S/C7H15BOSi/c1-10(2,8)7-5-3-4-6-9-7/h7H,3-6H2,1-2H3
InChIKeyYUQQTAOSILQKEF-UHFFFAOYSA-N
XLogP1.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.09
LogP ≤ 51.47
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 87087119?
The IUPAC name of CID 87087119 (CID 87087119) is not available.
What is the SMILES notation for CID 87087119?
The canonical SMILES for CID 87087119 is [B][Si](C)(C)C1CCCCO1.
What is the InChIKey of CID 87087119?
The InChIKey is YUQQTAOSILQKEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15BOSi/c1-10(2,8)7-5-3-4-6-9-7/h7H,3-6H2,1-2H3.
What are the key properties of CID 87087119?
CID 87087119 has a molecular weight of 154.09 g/mol, XLogP of 1.47, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87087119 is sourced from PubChem (CID 87087119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).