CID 10893883

C22H18FeSi — CID 10893883

IUPAC—
SMILES[CH]1[CH][CH][C]([Si]([C]2[CH][CH][CH][CH]2)(c2ccccc2)c2ccccc2)[CH]1.[Fe]
InChIInChI=1S/C22H18Si.Fe/c1-3-11-19(12-4-1)23(21-15-7-8-16-21,22-17-9-10-18-22)20-13-5-2-6-14-20;/h1-18H;
InChIKeyMJLNBMOUCROMOV-UHFFFAOYSA-N
MW366.32 g/mol
LogP3.14
Rot. Bonds4

About CID 10893883

CID 10893883 (PubChem CID 10893883) has the molecular formula C22H18FeSi and a molecular weight of 366.32 g/mol.

Molecular Properties

Compound NameCID 10893883
PubChem CID10893883
Molecular FormulaC22H18FeSi
Molecular Weight366.32 g/mol
Exact Mass366.05
IUPAC Name—
SMILES[CH]1[CH][CH][C]([Si]([C]2[CH][CH][CH][CH]2)(c2ccccc2)c2ccccc2)[CH]1.[Fe]
InChIInChI=1S/C22H18Si.Fe/c1-3-11-19(12-4-1)23(21-15-7-8-16-21,22-17-9-10-18-22)20-13-5-2-6-14-20;/h1-18H;
InChIKeyMJLNBMOUCROMOV-UHFFFAOYSA-N
XLogP3.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.32
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 10893883?
The IUPAC name of CID 10893883 (CID 10893883) is not available.
What is the SMILES notation for CID 10893883?
The canonical SMILES for CID 10893883 is [CH]1[CH][CH][C]([Si]([C]2[CH][CH][CH][CH]2)(c2ccccc2)c2ccccc2)[CH]1.[Fe].
What is the InChIKey of CID 10893883?
The InChIKey is MJLNBMOUCROMOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18Si.Fe/c1-3-11-19(12-4-1)23(21-15-7-8-16-21,22-17-9-10-18-22)20-13-5-2-6-14-20;/h1-18H;.
What are the key properties of CID 10893883?
CID 10893883 has a molecular weight of 366.32 g/mol, XLogP of 3.14, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10893883 is sourced from PubChem (CID 10893883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).