CID 101079672

C17H19OSi — CID 101079672

IUPAC—
SMILESC[Si](C)(C)O[C]=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19OSi/c1-19(2,3)18-14-17(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13H,1-3H3
InChIKeyQQFCKRGFVFGYMU-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.73
Rot. Bonds4

About CID 101079672

CID 101079672 (PubChem CID 101079672) has the molecular formula C17H19OSi and a molecular weight of 267.42 g/mol.

Molecular Properties

Compound NameCID 101079672
PubChem CID101079672
Molecular FormulaC17H19OSi
Molecular Weight267.42 g/mol
Exact Mass267.12
IUPAC Name—
SMILESC[Si](C)(C)O[C]=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19OSi/c1-19(2,3)18-14-17(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13H,1-3H3
InChIKeyQQFCKRGFVFGYMU-UHFFFAOYSA-N
XLogP4.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 101079672?
The IUPAC name of CID 101079672 (CID 101079672) is not available.
What is the SMILES notation for CID 101079672?
The canonical SMILES for CID 101079672 is C[Si](C)(C)O[C]=C(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 101079672?
The InChIKey is QQFCKRGFVFGYMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19OSi/c1-19(2,3)18-14-17(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13H,1-3H3.
What are the key properties of CID 101079672?
CID 101079672 has a molecular weight of 267.42 g/mol, XLogP of 4.73, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 101079672 is sourced from PubChem (CID 101079672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).