tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane

C18H38O4Si — CID 88791213

IUPACtributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane
SMILESC=C(C)COC(C)[Si](OCCCC)(OCCCC)OCCCC
InChIInChI=1S/C18H38O4Si/c1-7-10-13-20-23(21-14-11-8-2,22-15-12-9-3)18(6)19-16-17(4)5/h18H,4,7-16H2,1-3,5-6H3
InChIKeyJMUSCUHRFAVUMD-UHFFFAOYSA-N
MW346.58 g/mol
LogP4.90
Rot. Bonds16

About tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane

tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane (PubChem CID 88791213) has the molecular formula C18H38O4Si and a molecular weight of 346.58 g/mol. Its IUPAC name is tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane.

Molecular Properties

Compound Nametributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane
PubChem CID88791213
Molecular FormulaC18H38O4Si
Molecular Weight346.58 g/mol
Exact Mass346.25
IUPAC Nametributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane
SMILESC=C(C)COC(C)[Si](OCCCC)(OCCCC)OCCCC
InChIInChI=1S/C18H38O4Si/c1-7-10-13-20-23(21-14-11-8-2,22-15-12-9-3)18(6)19-16-17(4)5/h18H,4,7-16H2,1-3,5-6H3
InChIKeyJMUSCUHRFAVUMD-UHFFFAOYSA-N
XLogP4.90
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.58
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-methyl-3-(1-propoxyethoxy)prop-1-ene
CID 173289997
1-[1-[2-(2-methylprop-2-enoxy)ethoxy]propan-2-yloxy]butane
CID 58362293
dibutoxy-[3-(2-methylprop-2-enoxy)propyl]-propylsilane
CID 88829636
1-[2-(2-methylprop-2-enoxy)ethoxy]butane
CID 87922728
dibutoxy-ethyl-prop-1-en-2-ylsilane
CID 158701403
4-[1-ethoxyethyl(dimethoxy)silyl]oxybutyl 2-methylprop-2-enoate
CID 174420882
tributoxy(1-butoxybutyl)silane
CID 54422613
dibutoxy-di(propan-2-yl)silane
CID 14324874
3-(2-methylprop-2-enoxy)pentane
CID 123638560
1-(2-methylprop-2-enoxy)dodecane
CID 156690078
tetrakis[1-(2-methylprop-2-enoxy)ethyl] silicate
CID 87063889
[butoxy-bis(2-methylprop-2-enoyloxy)silyl] 2-methylprop-2-enoate
CID 88695289

Frequently Asked Questions

What is the IUPAC name of tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane?
The IUPAC name of tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane (CID 88791213) is tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane.
What is the SMILES notation for tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane?
The canonical SMILES for tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane is C=C(C)COC(C)[Si](OCCCC)(OCCCC)OCCCC.
What is the InChIKey of tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane?
The InChIKey is JMUSCUHRFAVUMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38O4Si/c1-7-10-13-20-23(21-14-11-8-2,22-15-12-9-3)18(6)19-16-17(4)5/h18H,4,7-16H2,1-3,5-6H3.
What are the key properties of tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane?
tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane has a molecular weight of 346.58 g/mol, XLogP of 4.90, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tributoxy-[1-(2-methylprop-2-enoxy)ethyl]silane is sourced from PubChem (CID 88791213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).