butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane

C20H36O2Si2 — CID 174111811

IUPACbutyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane
SMILESC=Cc1cccc(OCCC[Si](C)(C)CO[Si](C)(C)CCCC)c1
InChIInChI=1S/C20H36O2Si2/c1-7-9-16-24(5,6)22-18-23(3,4)15-11-14-21-20-13-10-12-19(8-2)17-20/h8,10,12-13,17H,2,7,9,11,14-16,18H2,1,3-6H3
InChIKeyBEVNHBLOFXWNRF-UHFFFAOYSA-N
MW364.68 g/mol
LogP6.37
Rot. Bonds12

About butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane

butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane (PubChem CID 174111811) has the molecular formula C20H36O2Si2 and a molecular weight of 364.68 g/mol. Its IUPAC name is butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane.

Molecular Properties

Compound Namebutyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane
PubChem CID174111811
Molecular FormulaC20H36O2Si2
Molecular Weight364.68 g/mol
Exact Mass364.23
IUPAC Namebutyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane
SMILESC=Cc1cccc(OCCC[Si](C)(C)CO[Si](C)(C)CCCC)c1
InChIInChI=1S/C20H36O2Si2/c1-7-9-16-24(5,6)22-18-23(3,4)15-11-14-21-20-13-10-12-19(8-2)17-20/h8,10,12-13,17H,2,7,9,11,14-16,18H2,1,3-6H3
InChIKeyBEVNHBLOFXWNRF-UHFFFAOYSA-N
XLogP6.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.68
LogP ≤ 56.37
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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Related Compounds

3-(3-ethenylphenoxy)propyl-ethoxy-dimethylsilane
CID 19006567
3-(3-ethenylphenoxy)propyl-dimethoxy-methylsilane
CID 19006582
1-ethenyl-3-pentoxybenzene;N-ethylethanamine
CID 68645274
4-(3-ethenylphenoxy)-N,N-dipropylbutan-1-amine
CID 68645781
1-ethenyl-3-ethoxybenzene
CID 11672687
1-butoxy-4-ethenylbenzene;1-ethenyl-4-heptoxybenzene;1-ethenyl-3-hexoxybenzene;1-ethenyl-4-(4-methoxybutoxy)benzene;1-ethenyl-4-nonoxybenzene;1-ethenyl-3-pentoxybenzene
CID 161207949
3-butoxybenzaldehyde;ethane
CID 91380350
N-[3-(3-ethenylphenoxy)propyl]-N-ethyl-2-methylpropan-2-amine
CID 91335967
(3-ethenylphenoxy)-diethyl-methylsilane
CID 18676753
(4-ethenylphenoxy)-dimethyl-pentylsilane
CID 172778168
1-[2-(3-ethenylphenoxy)ethyl]pyrrolidine
CID 176891275
1-octoxy-3-prop-2-enoxybenzene
CID 14202237

Frequently Asked Questions

What is the IUPAC name of butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane?
The IUPAC name of butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane (CID 174111811) is butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane.
What is the SMILES notation for butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane?
The canonical SMILES for butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane is C=Cc1cccc(OCCC[Si](C)(C)CO[Si](C)(C)CCCC)c1.
What is the InChIKey of butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane?
The InChIKey is BEVNHBLOFXWNRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36O2Si2/c1-7-9-16-24(5,6)22-18-23(3,4)15-11-14-21-20-13-10-12-19(8-2)17-20/h8,10,12-13,17H,2,7,9,11,14-16,18H2,1,3-6H3.
What are the key properties of butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane?
butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane has a molecular weight of 364.68 g/mol, XLogP of 6.37, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-[[3-(3-ethenylphenoxy)propyl-dimethylsilyl]methoxy]-dimethylsilane is sourced from PubChem (CID 174111811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).