butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane

C19H26O3Si — CID 91742927

IUPACbutoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane
SMILESCCCCO[Si](C)(C)OCc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C19H26O3Si/c1-4-5-15-20-23(2,3)21-16-17-11-13-19(14-12-17)22-18-9-7-6-8-10-18/h6-14H,4-5,15-16H2,1-3H3
InChIKeyZPQKFUKXECPLIO-UHFFFAOYSA-N
MW330.50 g/mol
LogP5.51
Rot. Bonds9

About butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane

butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane (PubChem CID 91742927) has the molecular formula C19H26O3Si and a molecular weight of 330.50 g/mol. Its IUPAC name is butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane.

Molecular Properties

Compound Namebutoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane
PubChem CID91742927
Molecular FormulaC19H26O3Si
Molecular Weight330.50 g/mol
Exact Mass330.17
IUPAC Namebutoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane
SMILESCCCCO[Si](C)(C)OCc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C19H26O3Si/c1-4-5-15-20-23(2,3)21-16-17-11-13-19(14-12-17)22-18-9-7-6-8-10-18/h6-14H,4-5,15-16H2,1-3H3
InChIKeyZPQKFUKXECPLIO-UHFFFAOYSA-N
XLogP5.51
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.50
LogP ≤ 55.51
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

(4-methoxyphenyl)methoxy-dimethyl-pentadecoxysilane
CID 91711163
decoxy-dimethyl-(pyridin-3-ylmethoxy)silane
CID 91700280
dimethyl-octoxy-(4-phenylphenoxy)silane
CID 91743735
butoxy-(4-ethylphenoxy)-dimethylsilane
CID 91738659
1-O-nonyl 10-O-[(4-phenoxyphenyl)methyl] decanedioate
CID 91732980
N-[(4-phenoxyphenyl)methyl]pentan-1-amine
CID 10754466
2-[2-(2-butoxyethoxy)ethoxy]ethoxy-[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilane
CID 91699999
octadecyl-tris(4-phenoxyphenyl)phosphanium
CID 102265785
ethane;1-phenoxy-4-[(4-phenoxyphenyl)methyl]benzene
CID 143793194
trifluoro-[(4-phenoxyphenyl)methyl]boranuide
CID 171374152
butoxymethylbenzene;ethane
CID 145341806
4-O-[(4-phenoxyphenyl)methyl] 1-O-propyl (E)-but-2-enedioate
CID 91743214

Frequently Asked Questions

What is the IUPAC name of butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane?
The IUPAC name of butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane (CID 91742927) is butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane.
What is the SMILES notation for butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane?
The canonical SMILES for butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane is CCCCO[Si](C)(C)OCc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane?
The InChIKey is ZPQKFUKXECPLIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26O3Si/c1-4-5-15-20-23(2,3)21-16-17-11-13-19(14-12-17)22-18-9-7-6-8-10-18/h6-14H,4-5,15-16H2,1-3H3.
What are the key properties of butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane?
butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane has a molecular weight of 330.50 g/mol, XLogP of 5.51, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-dimethyl-[(4-phenoxyphenyl)methoxy]silane is sourced from PubChem (CID 91742927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).