6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane

C15H29FO5 — CID 90441541

IUPAC6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane
SMILESCOC(C)C1(C)OC(F)C(C)(OC)C(C)(OC)C1(C)OC
InChIInChI=1S/C15H29FO5/c1-10(17-6)12(2)14(4,19-8)15(5,20-9)13(3,18-7)11(16)21-12/h10-11H,1-9H3
InChIKeyVQYVIKMUPTZEGL-UHFFFAOYSA-N
MW308.39 g/mol
LogP2.32
Rot. Bonds5

About 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane

6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane (PubChem CID 90441541) has the molecular formula C15H29FO5 and a molecular weight of 308.39 g/mol. Its IUPAC name is 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane.

Molecular Properties

Compound Name6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane
PubChem CID90441541
Molecular FormulaC15H29FO5
Molecular Weight308.39 g/mol
Exact Mass308.20
IUPAC Name6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane
SMILESCOC(C)C1(C)OC(F)C(C)(OC)C(C)(OC)C1(C)OC
InChIInChI=1S/C15H29FO5/c1-10(17-6)12(2)14(4,19-8)15(5,20-9)13(3,18-7)11(16)21-12/h10-11H,1-9H3
InChIKeyVQYVIKMUPTZEGL-UHFFFAOYSA-N
XLogP2.32
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane?
The IUPAC name of 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane (CID 90441541) is 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane.
What is the SMILES notation for 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane?
The canonical SMILES for 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane is COC(C)C1(C)OC(F)C(C)(OC)C(C)(OC)C1(C)OC.
What is the InChIKey of 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane?
The InChIKey is VQYVIKMUPTZEGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29FO5/c1-10(17-6)12(2)14(4,19-8)15(5,20-9)13(3,18-7)11(16)21-12/h10-11H,1-9H3.
What are the key properties of 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane?
6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane has a molecular weight of 308.39 g/mol, XLogP of 2.32, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3,4,5-trimethoxy-2-(1-methoxyethyl)-2,3,4,5-tetramethyloxane is sourced from PubChem (CID 90441541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).