ethenyl-methyl-phenoxy-tridecoxysilane

C22H38O2Si — CID 91743893

IUPACethenyl-methyl-phenoxy-tridecoxysilane
SMILESC=C[Si](C)(OCCCCCCCCCCCCC)Oc1ccccc1
InChIInChI=1S/C22H38O2Si/c1-4-6-7-8-9-10-11-12-13-14-18-21-23-25(3,5-2)24-22-19-16-15-17-20-22/h5,15-17,19-20H,2,4,6-14,18,21H2,1,3H3
InChIKeyRJBCHIXKXOLZFG-UHFFFAOYSA-N
MW362.63 g/mol
LogP7.19
Rot. Bonds16

About ethenyl-methyl-phenoxy-tridecoxysilane

ethenyl-methyl-phenoxy-tridecoxysilane (PubChem CID 91743893) has the molecular formula C22H38O2Si and a molecular weight of 362.63 g/mol. Its IUPAC name is ethenyl-methyl-phenoxy-tridecoxysilane.

Molecular Properties

Compound Nameethenyl-methyl-phenoxy-tridecoxysilane
PubChem CID91743893
Molecular FormulaC22H38O2Si
Molecular Weight362.63 g/mol
Exact Mass362.26
IUPAC Nameethenyl-methyl-phenoxy-tridecoxysilane
SMILESC=C[Si](C)(OCCCCCCCCCCCCC)Oc1ccccc1
InChIInChI=1S/C22H38O2Si/c1-4-6-7-8-9-10-11-12-13-14-18-21-23-25(3,5-2)24-22-19-16-15-17-20-22/h5,15-17,19-20H,2,4,6-14,18,21H2,1,3H3
InChIKeyRJBCHIXKXOLZFG-UHFFFAOYSA-N
XLogP7.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.63
LogP ≤ 57.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

dodecoxy-ethenyl-methyl-undecoxysilane
CID 91744966
ethenyl-heptoxy-hexadecoxy-methylsilane
CID 91744965
dodecoxy-ethenyl-methyl-pentadecoxysilane
CID 91745623
ethenyl-heptoxy-methyl-tridecoxysilane
CID 91744074
decoxy-ethenyl-methyl-nonoxysilane
CID 91743696
ethenyl-heptoxy-methyl-tetradecoxysilane
CID 91744411
butoxy-dodecoxy-ethenyl-methylsilane
CID 91742140
ethenyl-methyl-dipentoxysilane
CID 71381989
ethenyl-ethoxy-hexoxy-methylsilane
CID 91733084
ethenyl-pentoxy-diphenylsilane
CID 575251
dimethyl-octoxy-(4-phenylphenoxy)silane
CID 91743735
pentoxybenzene;undecane
CID 174778179

Frequently Asked Questions

What is the IUPAC name of ethenyl-methyl-phenoxy-tridecoxysilane?
The IUPAC name of ethenyl-methyl-phenoxy-tridecoxysilane (CID 91743893) is ethenyl-methyl-phenoxy-tridecoxysilane.
What is the SMILES notation for ethenyl-methyl-phenoxy-tridecoxysilane?
The canonical SMILES for ethenyl-methyl-phenoxy-tridecoxysilane is C=C[Si](C)(OCCCCCCCCCCCCC)Oc1ccccc1.
What is the InChIKey of ethenyl-methyl-phenoxy-tridecoxysilane?
The InChIKey is RJBCHIXKXOLZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H38O2Si/c1-4-6-7-8-9-10-11-12-13-14-18-21-23-25(3,5-2)24-22-19-16-15-17-20-22/h5,15-17,19-20H,2,4,6-14,18,21H2,1,3H3.
What are the key properties of ethenyl-methyl-phenoxy-tridecoxysilane?
ethenyl-methyl-phenoxy-tridecoxysilane has a molecular weight of 362.63 g/mol, XLogP of 7.19, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-phenoxy-tridecoxysilane is sourced from PubChem (CID 91743893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).