[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane

C17H34O6Si — CID 165098217

IUPAC[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane
SMILESC=CCOCCOCC(COCC1COC(C)(C)O1)O[Si](C)(C)C
InChIInChI=1S/C17H34O6Si/c1-7-8-18-9-10-19-12-16(23-24(4,5)6)13-20-11-15-14-21-17(2,3)22-15/h7,15-16H,1,8-14H2,2-6H3
InChIKeyXWIWCPPSLVQCOY-UHFFFAOYSA-N
MW362.54 g/mol
LogP2.59
Rot. Bonds13

About [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane

[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane (PubChem CID 165098217) has the molecular formula C17H34O6Si and a molecular weight of 362.54 g/mol. Its IUPAC name is [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane
PubChem CID165098217
Molecular FormulaC17H34O6Si
Molecular Weight362.54 g/mol
Exact Mass362.21
IUPAC Name[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane
SMILESC=CCOCCOCC(COCC1COC(C)(C)O1)O[Si](C)(C)C
InChIInChI=1S/C17H34O6Si/c1-7-8-18-9-10-19-12-16(23-24(4,5)6)13-20-11-15-14-21-17(2,3)22-15/h7,15-16H,1,8-14H2,2-6H3
InChIKeyXWIWCPPSLVQCOY-UHFFFAOYSA-N
XLogP2.59
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.54
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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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Frequently Asked Questions

What is the IUPAC name of [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane?
The IUPAC name of [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane (CID 165098217) is [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane.
What is the SMILES notation for [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane?
The canonical SMILES for [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane is C=CCOCCOCC(COCC1COC(C)(C)O1)O[Si](C)(C)C.
What is the InChIKey of [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane?
The InChIKey is XWIWCPPSLVQCOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O6Si/c1-7-8-18-9-10-19-12-16(23-24(4,5)6)13-20-11-15-14-21-17(2,3)22-15/h7,15-16H,1,8-14H2,2-6H3.
What are the key properties of [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane?
[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane has a molecular weight of 362.54 g/mol, XLogP of 2.59, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-3-(2-prop-2-enoxyethoxy)propan-2-yl]oxy-trimethylsilane is sourced from PubChem (CID 165098217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).