tert-butyl(4-phenylbutoxy)silane

C14H24OSi — CID 154145824

IUPACtert-butyl(4-phenylbutoxy)silane
SMILESCC(C)(C)[SiH2]OCCCCc1ccccc1
InChIInChI=1S/C14H24OSi/c1-14(2,3)16-15-12-8-7-11-13-9-5-4-6-10-13/h4-6,9-10H,7-8,11-12,16H2,1-3H3
InChIKeyYWJQUMSCGNGALA-UHFFFAOYSA-N
MW236.43 g/mol
LogP3.33
Rot. Bonds6

About tert-butyl(4-phenylbutoxy)silane

tert-butyl(4-phenylbutoxy)silane (PubChem CID 154145824) has the molecular formula C14H24OSi and a molecular weight of 236.43 g/mol. Its IUPAC name is tert-butyl(4-phenylbutoxy)silane.

Molecular Properties

Compound Nametert-butyl(4-phenylbutoxy)silane
PubChem CID154145824
Molecular FormulaC14H24OSi
Molecular Weight236.43 g/mol
Exact Mass236.16
IUPAC Nametert-butyl(4-phenylbutoxy)silane
SMILESCC(C)(C)[SiH2]OCCCCc1ccccc1
InChIInChI=1S/C14H24OSi/c1-14(2,3)16-15-12-8-7-11-13-9-5-4-6-10-13/h4-6,9-10H,7-8,11-12,16H2,1-3H3
InChIKeyYWJQUMSCGNGALA-UHFFFAOYSA-N
XLogP3.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.43
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-[(2-methylpropan-2-yl)oxy]butylbenzene
CID 14937175
2-methyl-2-(4-phenylbutoxy)propan-1-amine
CID 114332862
7-methoxyheptylbenzene
CID 54276867
4-phenylbutylbenzene
CID 141301927
8-(8-phenyloctoxy)octylbenzene
CID 56628536
4-phenylbutyl hypochlorite
CID 165357420
methane;4-phenylbutylbenzene
CID 173386802
hafnium;4-phenylbutylbenzene
CID 175889972
6-ethoxyhexylbenzene
CID 54300935
2-methyl-2-(3-phenylpropoxy)propan-1-amine
CID 62354830
27,27-dimethyloctacosylbenzene
CID 140589361
10-butoxydecylbenzene
CID 151496754

Frequently Asked Questions

What is the IUPAC name of tert-butyl(4-phenylbutoxy)silane?
The IUPAC name of tert-butyl(4-phenylbutoxy)silane (CID 154145824) is tert-butyl(4-phenylbutoxy)silane.
What is the SMILES notation for tert-butyl(4-phenylbutoxy)silane?
The canonical SMILES for tert-butyl(4-phenylbutoxy)silane is CC(C)(C)[SiH2]OCCCCc1ccccc1.
What is the InChIKey of tert-butyl(4-phenylbutoxy)silane?
The InChIKey is YWJQUMSCGNGALA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24OSi/c1-14(2,3)16-15-12-8-7-11-13-9-5-4-6-10-13/h4-6,9-10H,7-8,11-12,16H2,1-3H3.
What are the key properties of tert-butyl(4-phenylbutoxy)silane?
tert-butyl(4-phenylbutoxy)silane has a molecular weight of 236.43 g/mol, XLogP of 3.33, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl(4-phenylbutoxy)silane is sourced from PubChem (CID 154145824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).