CID 174677552

C3H8ClOSi — CID 174677552

IUPAC—
SMILESCOC[SiH]CCl
InChIInChI=1S/C3H8ClOSi/c1-5-3-6-2-4/h6H,2-3H2,1H3
InChIKeyOJPNMZGTCMEHOW-UHFFFAOYSA-N
MW123.63 g/mol
LogP0.22
Rot. Bonds3

About CID 174677552

CID 174677552 (PubChem CID 174677552) has the molecular formula C3H8ClOSi and a molecular weight of 123.63 g/mol.

Molecular Properties

Compound NameCID 174677552
PubChem CID174677552
Molecular FormulaC3H8ClOSi
Molecular Weight123.63 g/mol
Exact Mass123.00
IUPAC Name—
SMILESCOC[SiH]CCl
InChIInChI=1S/C3H8ClOSi/c1-5-3-6-2-4/h6H,2-3H2,1H3
InChIKeyOJPNMZGTCMEHOW-UHFFFAOYSA-N
XLogP0.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.63
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 174677552?
The IUPAC name of CID 174677552 (CID 174677552) is not available.
What is the SMILES notation for CID 174677552?
The canonical SMILES for CID 174677552 is COC[SiH]CCl.
What is the InChIKey of CID 174677552?
The InChIKey is OJPNMZGTCMEHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8ClOSi/c1-5-3-6-2-4/h6H,2-3H2,1H3.
What are the key properties of CID 174677552?
CID 174677552 has a molecular weight of 123.63 g/mol, XLogP of 0.22, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174677552 is sourced from PubChem (CID 174677552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).