2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane

C18H38O5Si — CID 141199986

IUPAC2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane
SMILESCCC[Si](OC(C)C)(OC(C)C)OC(C)(C)C1(CC)OCCCO1
InChIInChI=1S/C18H38O5Si/c1-9-14-24(21-15(3)4,22-16(5)6)23-17(7,8)18(10-2)19-12-11-13-20-18/h15-16H,9-14H2,1-8H3
InChIKeyXUCAVRRBIVDPKT-UHFFFAOYSA-N
MW362.58 g/mol
LogP4.52
Rot. Bonds10

About 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane

2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane (PubChem CID 141199986) has the molecular formula C18H38O5Si and a molecular weight of 362.58 g/mol. Its IUPAC name is 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane.

Molecular Properties

Compound Name2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane
PubChem CID141199986
Molecular FormulaC18H38O5Si
Molecular Weight362.58 g/mol
Exact Mass362.25
IUPAC Name2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane
SMILESCCC[Si](OC(C)C)(OC(C)C)OC(C)(C)C1(CC)OCCCO1
InChIInChI=1S/C18H38O5Si/c1-9-14-24(21-15(3)4,22-16(5)6)23-17(7,8)18(10-2)19-12-11-13-20-18/h15-16H,9-14H2,1-8H3
InChIKeyXUCAVRRBIVDPKT-UHFFFAOYSA-N
XLogP4.52
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.58
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[1-(2-ethyl-1,3-dioxan-2-yl)-2-methylpropan-2-yl]oxy-methyl-[(2-methylpropan-2-yl)oxy]-propylsilane
CID 141259847
(2-ethyl-1,3-dioxan-2-yl)-dimethoxy-propylsilane
CID 141167016
dichloro-[1-(2-ethyl-1,3-dioxan-2-yl)butyl]-propylsilane
CID 141250407
1-(2-ethyl-1,3-dioxan-2-yl)octyl-dimethyl-propylsilane
CID 168875222
oxirane;trimethoxy(propyl)silane
CID 87981276
(3-methyloxetan-3-yl)methyl-tri(propan-2-yloxy)silane
CID 141199974
tri(propan-2-yloxy)-[4-tri(propan-2-yloxy)silylbutyl]silane
CID 87144652
1-(2,4-diethyl-1,3-dioxetan-2-yl)ethoxy-diethoxy-propylsilane
CID 171481390
chloromethoxy-(2-ethyl-1,3-dioxan-2-yl)-methoxy-propylsilane
CID 141250184
[2-(2-ethyl-1,3-dioxan-2-yl)phenoxy]-diphenoxy-propylsilane
CID 141170369
dibutyl-methyl-propan-2-yloxysilane
CID 87144451
3-[methoxy-(methoxy-propan-2-yloxy-propylsilyl)oxy-propan-2-yloxysilyl]-N,N-dimethylpropan-1-amine
CID 169021842

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane?
The IUPAC name of 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane (CID 141199986) is 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane.
What is the SMILES notation for 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane?
The canonical SMILES for 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane is CCC[Si](OC(C)C)(OC(C)C)OC(C)(C)C1(CC)OCCCO1.
What is the InChIKey of 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane?
The InChIKey is XUCAVRRBIVDPKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38O5Si/c1-9-14-24(21-15(3)4,22-16(5)6)23-17(7,8)18(10-2)19-12-11-13-20-18/h15-16H,9-14H2,1-8H3.
What are the key properties of 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane?
2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane has a molecular weight of 362.58 g/mol, XLogP of 4.52, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-1,3-dioxan-2-yl)propan-2-yloxy-di(propan-2-yloxy)-propylsilane is sourced from PubChem (CID 141199986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).