CID 87438443

C16H13Si — CID 87438443

IUPAC—
SMILESC1=c2ccccc2=CC1=[Si]Cc1ccccc1
InChIInChI=1S/C16H13Si/c1-2-6-13(7-3-1)12-17-16-10-14-8-4-5-9-15(14)11-16/h1-11H,12H2
InChIKeyPRWIWLOZUVWSKJ-UHFFFAOYSA-N
MW233.37 g/mol
LogP1.34
Rot. Bonds2

About CID 87438443

CID 87438443 (PubChem CID 87438443) has the molecular formula C16H13Si and a molecular weight of 233.37 g/mol.

Molecular Properties

Compound NameCID 87438443
PubChem CID87438443
Molecular FormulaC16H13Si
Molecular Weight233.37 g/mol
Exact Mass233.08
IUPAC Name—
SMILESC1=c2ccccc2=CC1=[Si]Cc1ccccc1
InChIInChI=1S/C16H13Si/c1-2-6-13(7-3-1)12-17-16-10-14-8-4-5-9-15(14)11-16/h1-11H,12H2
InChIKeyPRWIWLOZUVWSKJ-UHFFFAOYSA-N
XLogP1.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.37
LogP ≤ 51.34
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 87438443?
The IUPAC name of CID 87438443 (CID 87438443) is not available.
What is the SMILES notation for CID 87438443?
The canonical SMILES for CID 87438443 is C1=c2ccccc2=CC1=[Si]Cc1ccccc1.
What is the InChIKey of CID 87438443?
The InChIKey is PRWIWLOZUVWSKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Si/c1-2-6-13(7-3-1)12-17-16-10-14-8-4-5-9-15(14)11-16/h1-11H,12H2.
What are the key properties of CID 87438443?
CID 87438443 has a molecular weight of 233.37 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87438443 is sourced from PubChem (CID 87438443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).