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

C20H37ClO3Si2 — CID 91741168

IUPAC(2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane
SMILESCCCCCCCCCCO[Si](C)(C)O[Si](C)(C)Oc1ccccc1Cl
InChIInChI=1S/C20H37ClO3Si2/c1-6-7-8-9-10-11-12-15-18-22-25(2,3)24-26(4,5)23-20-17-14-13-16-19(20)21/h13-14,16-17H,6-12,15,18H2,1-5H3
InChIKeyXGNSSQCVQGTAHO-UHFFFAOYSA-N
MW417.14 g/mol
LogP7.30
Rot. Bonds14

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

(2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane (PubChem CID 91741168) has the molecular formula C20H37ClO3Si2 and a molecular weight of 417.14 g/mol. Its IUPAC name is (2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane.

Molecular Properties

Compound Name(2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane
PubChem CID91741168
Molecular FormulaC20H37ClO3Si2
Molecular Weight417.14 g/mol
Exact Mass416.20
IUPAC Name(2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane
SMILESCCCCCCCCCCO[Si](C)(C)O[Si](C)(C)Oc1ccccc1Cl
InChIInChI=1S/C20H37ClO3Si2/c1-6-7-8-9-10-11-12-15-18-22-25(2,3)24-26(4,5)23-20-17-14-13-16-19(20)21/h13-14,16-17H,6-12,15,18H2,1-5H3
InChIKeyXGNSSQCVQGTAHO-UHFFFAOYSA-N
XLogP7.30
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.14
LogP ≤ 57.30
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)-[dimethyl(undecoxy)silyl]oxy-dimethylsilane
CID 91741759
(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)-[decoxy(dimethyl)silyl]oxy-dimethylsilane?
The IUPAC name of (2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane (CID 91741168) is (2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane.
What is the SMILES notation for (2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane?
The canonical SMILES for (2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane is CCCCCCCCCCO[Si](C)(C)O[Si](C)(C)Oc1ccccc1Cl.
What is the InChIKey of (2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane?
The InChIKey is XGNSSQCVQGTAHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H37ClO3Si2/c1-6-7-8-9-10-11-12-15-18-22-25(2,3)24-26(4,5)23-20-17-14-13-16-19(20)21/h13-14,16-17H,6-12,15,18H2,1-5H3.
What are the key properties of (2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane?
(2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane has a molecular weight of 417.14 g/mol, XLogP of 7.30, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenoxy)-[decoxy(dimethyl)silyl]oxy-dimethylsilane is sourced from PubChem (CID 91741168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).