5,5-bis(ethoxymethyl)nonane

C15H32O2 — CID 22140507

IUPAC5,5-bis(ethoxymethyl)nonane
SMILESCCCCC(CCCC)(COCC)COCC
InChIInChI=1S/C15H32O2/c1-5-9-11-15(12-10-6-2,13-16-7-3)14-17-8-4/h5-14H2,1-4H3
InChIKeyNDTLNHGFAUSCAE-UHFFFAOYSA-N
MW244.42 g/mol
LogP4.43
Rot. Bonds12

About 5,5-bis(ethoxymethyl)nonane

5,5-bis(ethoxymethyl)nonane (PubChem CID 22140507) has the molecular formula C15H32O2 and a molecular weight of 244.42 g/mol. Its IUPAC name is 5,5-bis(ethoxymethyl)nonane.

Molecular Properties

Compound Name5,5-bis(ethoxymethyl)nonane
PubChem CID22140507
Molecular FormulaC15H32O2
Molecular Weight244.42 g/mol
Exact Mass244.24
IUPAC Name5,5-bis(ethoxymethyl)nonane
SMILESCCCCC(CCCC)(COCC)COCC
InChIInChI=1S/C15H32O2/c1-5-9-11-15(12-10-6-2,13-16-7-3)14-17-8-4/h5-14H2,1-4H3
InChIKeyNDTLNHGFAUSCAE-UHFFFAOYSA-N
XLogP4.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.42
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,5-bis(ethoxymethyl)nonane?
The IUPAC name of 5,5-bis(ethoxymethyl)nonane (CID 22140507) is 5,5-bis(ethoxymethyl)nonane.
What is the SMILES notation for 5,5-bis(ethoxymethyl)nonane?
The canonical SMILES for 5,5-bis(ethoxymethyl)nonane is CCCCC(CCCC)(COCC)COCC.
What is the InChIKey of 5,5-bis(ethoxymethyl)nonane?
The InChIKey is NDTLNHGFAUSCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2/c1-5-9-11-15(12-10-6-2,13-16-7-3)14-17-8-4/h5-14H2,1-4H3.
What are the key properties of 5,5-bis(ethoxymethyl)nonane?
5,5-bis(ethoxymethyl)nonane has a molecular weight of 244.42 g/mol, XLogP of 4.43, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-bis(ethoxymethyl)nonane is sourced from PubChem (CID 22140507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).