CID 140577627

C3H9ClI3SiV — CID 140577627

IUPAC—
SMILESC[Si](C)C.Cl[V](I)(I)I
InChIInChI=1S/C3H9Si.ClH.3HI.V/c1-4(2)3;;;;;/h1-3H3;4*1H;/q;;;;;+4/p-4
InChIKeyCYKXWXYQYJYOIF-UHFFFAOYSA-J
MW540.30 g/mol
LogP4.71
Rot. Bonds

About CID 140577627

CID 140577627 (PubChem CID 140577627) has the molecular formula C3H9ClI3SiV and a molecular weight of 540.30 g/mol.

Molecular Properties

Compound NameCID 140577627
PubChem CID140577627
Molecular FormulaC3H9ClI3SiV
Molecular Weight540.30 g/mol
Exact Mass539.67
IUPAC Name—
SMILESC[Si](C)C.Cl[V](I)(I)I
InChIInChI=1S/C3H9Si.ClH.3HI.V/c1-4(2)3;;;;;/h1-3H3;4*1H;/q;;;;;+4/p-4
InChIKeyCYKXWXYQYJYOIF-UHFFFAOYSA-J
XLogP4.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500540.30
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 140577627?
The IUPAC name of CID 140577627 (CID 140577627) is not available.
What is the SMILES notation for CID 140577627?
The canonical SMILES for CID 140577627 is C[Si](C)C.Cl[V](I)(I)I.
What is the InChIKey of CID 140577627?
The InChIKey is CYKXWXYQYJYOIF-UHFFFAOYSA-J. The full InChI is InChI=1S/C3H9Si.ClH.3HI.V/c1-4(2)3;;;;;/h1-3H3;4*1H;/q;;;;;+4/p-4.
What are the key properties of CID 140577627?
CID 140577627 has a molecular weight of 540.30 g/mol, XLogP of 4.71, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 140577627 is sourced from PubChem (CID 140577627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).