CID 87333954

C15H24ClOSi — CID 87333954

IUPAC—
SMILESC[Si](C)c1c(CCCCl)ccc(O)c1C(C)(C)C
InChIInChI=1S/C15H24ClOSi/c1-15(2,3)13-12(17)9-8-11(7-6-10-16)14(13)18(4)5/h8-9,17H,6-7,10H2,1-5H3
InChIKeyACOKZKXKWDFOPR-UHFFFAOYSA-N
MW283.89 g/mol
LogP3.82
Rot. Bonds4

About CID 87333954

CID 87333954 (PubChem CID 87333954) has the molecular formula C15H24ClOSi and a molecular weight of 283.89 g/mol.

Molecular Properties

Compound NameCID 87333954
PubChem CID87333954
Molecular FormulaC15H24ClOSi
Molecular Weight283.89 g/mol
Exact Mass283.13
IUPAC Name—
SMILESC[Si](C)c1c(CCCCl)ccc(O)c1C(C)(C)C
InChIInChI=1S/C15H24ClOSi/c1-15(2,3)13-12(17)9-8-11(7-6-10-16)14(13)18(4)5/h8-9,17H,6-7,10H2,1-5H3
InChIKeyACOKZKXKWDFOPR-UHFFFAOYSA-N
XLogP3.82
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.89
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 87333954?
The IUPAC name of CID 87333954 (CID 87333954) is not available.
What is the SMILES notation for CID 87333954?
The canonical SMILES for CID 87333954 is C[Si](C)c1c(CCCCl)ccc(O)c1C(C)(C)C.
What is the InChIKey of CID 87333954?
The InChIKey is ACOKZKXKWDFOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ClOSi/c1-15(2,3)13-12(17)9-8-11(7-6-10-16)14(13)18(4)5/h8-9,17H,6-7,10H2,1-5H3.
What are the key properties of CID 87333954?
CID 87333954 has a molecular weight of 283.89 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87333954 is sourced from PubChem (CID 87333954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).