CID 135072991

C17H21OSi — CID 135072991

IUPAC—
SMILESC[Si](C)c1ccccc1CCOCc1ccccc1
InChIInChI=1S/C17H21OSi/c1-19(2)17-11-7-6-10-16(17)12-13-18-14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
InChIKeyDWFRLVFHFITSTR-UHFFFAOYSA-N
MW269.44 g/mol
LogP3.41
Rot. Bonds6

About CID 135072991

CID 135072991 (PubChem CID 135072991) has the molecular formula C17H21OSi and a molecular weight of 269.44 g/mol.

Molecular Properties

Compound NameCID 135072991
PubChem CID135072991
Molecular FormulaC17H21OSi
Molecular Weight269.44 g/mol
Exact Mass269.14
IUPAC Name—
SMILESC[Si](C)c1ccccc1CCOCc1ccccc1
InChIInChI=1S/C17H21OSi/c1-19(2)17-11-7-6-10-16(17)12-13-18-14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
InChIKeyDWFRLVFHFITSTR-UHFFFAOYSA-N
XLogP3.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.44
LogP ≤ 53.41
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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Related Compounds

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CID 137452332
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Frequently Asked Questions

What is the IUPAC name of CID 135072991?
The IUPAC name of CID 135072991 (CID 135072991) is not available.
What is the SMILES notation for CID 135072991?
The canonical SMILES for CID 135072991 is C[Si](C)c1ccccc1CCOCc1ccccc1.
What is the InChIKey of CID 135072991?
The InChIKey is DWFRLVFHFITSTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21OSi/c1-19(2)17-11-7-6-10-16(17)12-13-18-14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3.
What are the key properties of CID 135072991?
CID 135072991 has a molecular weight of 269.44 g/mol, XLogP of 3.41, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 135072991 is sourced from PubChem (CID 135072991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).