CID 174483797

C15H24BrOSi — CID 174483797

IUPAC—
SMILESC[Si](C)C(C)(C)COCCCc1ccccc1Br
InChIInChI=1S/C15H24BrOSi/c1-15(2,18(3)4)12-17-11-7-9-13-8-5-6-10-14(13)16/h5-6,8,10H,7,9,11-12H2,1-4H3
InChIKeyVGEXOKIZQDICAX-UHFFFAOYSA-N
MW328.35 g/mol
LogP4.93
Rot. Bonds7

About CID 174483797

CID 174483797 (PubChem CID 174483797) has the molecular formula C15H24BrOSi and a molecular weight of 328.35 g/mol.

Molecular Properties

Compound NameCID 174483797
PubChem CID174483797
Molecular FormulaC15H24BrOSi
Molecular Weight328.35 g/mol
Exact Mass327.08
IUPAC Name—
SMILESC[Si](C)C(C)(C)COCCCc1ccccc1Br
InChIInChI=1S/C15H24BrOSi/c1-15(2,18(3)4)12-17-11-7-9-13-8-5-6-10-14(13)16/h5-6,8,10H,7,9,11-12H2,1-4H3
InChIKeyVGEXOKIZQDICAX-UHFFFAOYSA-N
XLogP4.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.35
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 174483797?
The IUPAC name of CID 174483797 (CID 174483797) is not available.
What is the SMILES notation for CID 174483797?
The canonical SMILES for CID 174483797 is C[Si](C)C(C)(C)COCCCc1ccccc1Br.
What is the InChIKey of CID 174483797?
The InChIKey is VGEXOKIZQDICAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24BrOSi/c1-15(2,18(3)4)12-17-11-7-9-13-8-5-6-10-14(13)16/h5-6,8,10H,7,9,11-12H2,1-4H3.
What are the key properties of CID 174483797?
CID 174483797 has a molecular weight of 328.35 g/mol, XLogP of 4.93, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174483797 is sourced from PubChem (CID 174483797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).