CID 159052799

C7H6ClSi — CID 159052799

IUPAC—
SMILESCc1cc([Si])cc(Cl)c1
InChIInChI=1S/C7H6ClSi/c1-5-2-6(8)4-7(9)3-5/h2-4H,1H3
InChIKeySDMVRMJOBXNHLS-UHFFFAOYSA-N
MW153.66 g/mol
LogP1.44
Rot. Bonds

About CID 159052799

CID 159052799 (PubChem CID 159052799) has the molecular formula C7H6ClSi and a molecular weight of 153.66 g/mol.

Molecular Properties

Compound NameCID 159052799
PubChem CID159052799
Molecular FormulaC7H6ClSi
Molecular Weight153.66 g/mol
Exact Mass152.99
IUPAC Name—
SMILESCc1cc([Si])cc(Cl)c1
InChIInChI=1S/C7H6ClSi/c1-5-2-6(8)4-7(9)3-5/h2-4H,1H3
InChIKeySDMVRMJOBXNHLS-UHFFFAOYSA-N
XLogP1.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.66
LogP ≤ 51.44
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 159052799?
The IUPAC name of CID 159052799 (CID 159052799) is not available.
What is the SMILES notation for CID 159052799?
The canonical SMILES for CID 159052799 is Cc1cc([Si])cc(Cl)c1.
What is the InChIKey of CID 159052799?
The InChIKey is SDMVRMJOBXNHLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClSi/c1-5-2-6(8)4-7(9)3-5/h2-4H,1H3.
What are the key properties of CID 159052799?
CID 159052799 has a molecular weight of 153.66 g/mol, XLogP of 1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159052799 is sourced from PubChem (CID 159052799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).