CID 88824180

C6H11NOSb — CID 88824180

IUPAC—
SMILESC=CN1CCOCC1.[Sb]
InChIInChI=1S/C6H11NO.Sb/c1-2-7-3-5-8-6-4-7;/h2H,1,3-6H2;
InChIKeyIFORMGKXMROEIN-UHFFFAOYSA-N
MW234.92 g/mol
LogP0.08
Rot. Bonds1

About CID 88824180

CID 88824180 (PubChem CID 88824180) has the molecular formula C6H11NOSb and a molecular weight of 234.92 g/mol.

Molecular Properties

Compound NameCID 88824180
PubChem CID88824180
Molecular FormulaC6H11NOSb
Molecular Weight234.92 g/mol
Exact Mass233.99
IUPAC Name—
SMILESC=CN1CCOCC1.[Sb]
InChIInChI=1S/C6H11NO.Sb/c1-2-7-3-5-8-6-4-7;/h2H,1,3-6H2;
InChIKeyIFORMGKXMROEIN-UHFFFAOYSA-N
XLogP0.08
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.92
LogP ≤ 50.08
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 88824180?
The IUPAC name of CID 88824180 (CID 88824180) is not available.
What is the SMILES notation for CID 88824180?
The canonical SMILES for CID 88824180 is C=CN1CCOCC1.[Sb].
What is the InChIKey of CID 88824180?
The InChIKey is IFORMGKXMROEIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.Sb/c1-2-7-3-5-8-6-4-7;/h2H,1,3-6H2;.
What are the key properties of CID 88824180?
CID 88824180 has a molecular weight of 234.92 g/mol, XLogP of 0.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88824180 is sourced from PubChem (CID 88824180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).