(2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane

C21H39ClO3Si2 — CID 91741759

IUPAC(2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane
SMILESCCCCCCCCCCCO[Si](C)(C)O[Si](C)(C)Oc1ccccc1Cl
InChIInChI=1S/C21H39ClO3Si2/c1-6-7-8-9-10-11-12-13-16-19-23-26(2,3)25-27(4,5)24-21-18-15-14-17-20(21)22/h14-15,17-18H,6-13,16,19H2,1-5H3
InChIKeyOYRGMNIHPFMIIP-UHFFFAOYSA-N
MW431.17 g/mol
LogP7.69
Rot. Bonds15

About (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane

(2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane (PubChem CID 91741759) has the molecular formula C21H39ClO3Si2 and a molecular weight of 431.17 g/mol. Its IUPAC name is (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane.

Molecular Properties

Compound Name(2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane
PubChem CID91741759
Molecular FormulaC21H39ClO3Si2
Molecular Weight431.17 g/mol
Exact Mass430.21
IUPAC Name(2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane
SMILESCCCCCCCCCCCO[Si](C)(C)O[Si](C)(C)Oc1ccccc1Cl
InChIInChI=1S/C21H39ClO3Si2/c1-6-7-8-9-10-11-12-13-16-19-23-26(2,3)25-27(4,5)24-21-18-15-14-17-20(21)22/h14-15,17-18H,6-13,16,19H2,1-5H3
InChIKeyOYRGMNIHPFMIIP-UHFFFAOYSA-N
XLogP7.69
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.17
LogP ≤ 57.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

(2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane
CID 91741168
(2-chlorophenoxy)-dimethyl-tetradecoxysilane
CID 91744415
hexadecoxy-dimethyl-(2-methylphenoxy)silane
CID 91744863
dodecoxy-(2-fluorophenoxy)-dimethylsilane
CID 91743647
(2-chloro-5-methylphenoxy)-dodecoxy-dimethylsilane
CID 91744089
dimethyl-octoxy-(2-phenylphenoxy)silane
CID 91734404
dodecoxy-dimethyl-(2-phenylphenoxy)silane
CID 91744976
bis[[hexoxy(dimethyl)silyl]oxy]-dimethylsilane
CID 22506143
[dimethyl(nonoxy)silyl]oxy-(3-fluorophenoxy)-dimethylsilane
CID 91740398
(2,6-dimethoxyphenoxy)-dimethyl-pentoxysilane
CID 91740000
hexoxy-dimethyl-nonoxysilane
CID 91741085
hexoxy-dimethyl-undecoxysilane
CID 91742305

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane?
The IUPAC name of (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane (CID 91741759) is (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane.
What is the SMILES notation for (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane?
The canonical SMILES for (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane is CCCCCCCCCCCO[Si](C)(C)O[Si](C)(C)Oc1ccccc1Cl.
What is the InChIKey of (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane?
The InChIKey is OYRGMNIHPFMIIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H39ClO3Si2/c1-6-7-8-9-10-11-12-13-16-19-23-26(2,3)25-27(4,5)24-21-18-15-14-17-20(21)22/h14-15,17-18H,6-13,16,19H2,1-5H3.
What are the key properties of (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane?
(2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane has a molecular weight of 431.17 g/mol, XLogP of 7.69, 15 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenoxy)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane is sourced from PubChem (CID 91741759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).