CID 18719557

C15H23O4Si2 — CID 18719557

IUPAC—
SMILESC=C(C)C(=O)OC[Si](C)O[Si](C)(C)Cc1ccccc1O
InChIInChI=1S/C15H23O4Si2/c1-12(2)15(17)18-11-20(3)19-21(4,5)10-13-8-6-7-9-14(13)16/h6-9,16H,1,10-11H2,2-5H3
InChIKeyIELLQGAMXNOFEE-UHFFFAOYSA-N
MW323.52 g/mol
LogP2.98
Rot. Bonds7

About CID 18719557

CID 18719557 (PubChem CID 18719557) has the molecular formula C15H23O4Si2 and a molecular weight of 323.52 g/mol.

Molecular Properties

Compound NameCID 18719557
PubChem CID18719557
Molecular FormulaC15H23O4Si2
Molecular Weight323.52 g/mol
Exact Mass323.11
IUPAC Name—
SMILESC=C(C)C(=O)OC[Si](C)O[Si](C)(C)Cc1ccccc1O
InChIInChI=1S/C15H23O4Si2/c1-12(2)15(17)18-11-20(3)19-21(4,5)10-13-8-6-7-9-14(13)16/h6-9,16H,1,10-11H2,2-5H3
InChIKeyIELLQGAMXNOFEE-UHFFFAOYSA-N
XLogP2.98
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.52
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

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benzyl 2-methylprop-2-enoate;hydrofluoride
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2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;toluene
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Frequently Asked Questions

What is the IUPAC name of CID 18719557?
The IUPAC name of CID 18719557 (CID 18719557) is not available.
What is the SMILES notation for CID 18719557?
The canonical SMILES for CID 18719557 is C=C(C)C(=O)OC[Si](C)O[Si](C)(C)Cc1ccccc1O.
What is the InChIKey of CID 18719557?
The InChIKey is IELLQGAMXNOFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23O4Si2/c1-12(2)15(17)18-11-20(3)19-21(4,5)10-13-8-6-7-9-14(13)16/h6-9,16H,1,10-11H2,2-5H3.
What are the key properties of CID 18719557?
CID 18719557 has a molecular weight of 323.52 g/mol, XLogP of 2.98, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18719557 is sourced from PubChem (CID 18719557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).