tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane

C19H34O2Si — CID 11186346

IUPACtert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane
SMILESCC(C)(C)[Si](C)(C)OCCCCCCOCc1ccccc1
InChIInChI=1S/C19H34O2Si/c1-19(2,3)22(4,5)21-16-12-7-6-11-15-20-17-18-13-9-8-10-14-18/h8-10,13-14H,6-7,11-12,15-17H2,1-5H3
InChIKeyFYWMUDBYQLXAMO-UHFFFAOYSA-N
MW322.56 g/mol
LogP5.79
Rot. Bonds10

About tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane

tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane (PubChem CID 11186346) has the molecular formula C19H34O2Si and a molecular weight of 322.56 g/mol. Its IUPAC name is tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane
PubChem CID11186346
Molecular FormulaC19H34O2Si
Molecular Weight322.56 g/mol
Exact Mass322.23
IUPAC Nametert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane
SMILESCC(C)(C)[Si](C)(C)OCCCCCCOCc1ccccc1
InChIInChI=1S/C19H34O2Si/c1-19(2,3)22(4,5)21-16-12-7-6-11-15-20-17-18-13-9-8-10-14-18/h8-10,13-14H,6-7,11-12,15-17H2,1-5H3
InChIKeyFYWMUDBYQLXAMO-UHFFFAOYSA-N
XLogP5.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.56
LogP ≤ 55.79
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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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane (CID 11186346) is tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane is CC(C)(C)[Si](C)(C)OCCCCCCOCc1ccccc1.
What is the InChIKey of tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane?
The InChIKey is FYWMUDBYQLXAMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34O2Si/c1-19(2,3)22(4,5)21-16-12-7-6-11-15-20-17-18-13-9-8-10-14-18/h8-10,13-14H,6-7,11-12,15-17H2,1-5H3.
What are the key properties of tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane?
tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane has a molecular weight of 322.56 g/mol, XLogP of 5.79, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(6-phenylmethoxyhexoxy)silane is sourced from PubChem (CID 11186346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).