ethoxyethane;formaldehyde

C9H22O3 — CID 174286087

IUPACethoxyethane;formaldehyde
SMILESC=O.CCOCC.CCOCC
InChIInChI=1S/2C4H10O.CH2O/c2*1-3-5-4-2;1-2/h2*3-4H2,1-2H3;1H2
InChIKeyVDWFPMNKWDYLJV-UHFFFAOYSA-N
MW178.27 g/mol
LogP1.90
Rot. Bonds4

About ethoxyethane;formaldehyde

ethoxyethane;formaldehyde (PubChem CID 174286087) has the molecular formula C9H22O3 and a molecular weight of 178.27 g/mol. Its IUPAC name is ethoxyethane;formaldehyde.

Molecular Properties

Compound Nameethoxyethane;formaldehyde
PubChem CID174286087
Molecular FormulaC9H22O3
Molecular Weight178.27 g/mol
Exact Mass178.16
IUPAC Nameethoxyethane;formaldehyde
SMILESC=O.CCOCC.CCOCC
InChIInChI=1S/2C4H10O.CH2O/c2*1-3-5-4-2;1-2/h2*3-4H2,1-2H3;1H2
InChIKeyVDWFPMNKWDYLJV-UHFFFAOYSA-N
XLogP1.90
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.27
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethoxyethane
CID 18694919
ethoxyethane
CID 19002445
ethoxyethane;oxophosphane
CID 18547249
ethoxyethane;sulfane
CID 90240371
ethoxyethane;sulfane
CID 87243372
ethoxyethane;pentahydrate
CID 141041283
disodium;ethoxyethane
CID 23107014
ethoxyethane;hydrate
CID 22594236
strontium;ethoxyethane;hydride
CID 174808757
CID 135083812
CID 135083812
ethoxyethane;molybdenum;tetrahydrochloride
CID 174873486
aluminum;ethoxyethane;triiodide
CID 173390625

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;formaldehyde?
The IUPAC name of ethoxyethane;formaldehyde (CID 174286087) is ethoxyethane;formaldehyde.
What is the SMILES notation for ethoxyethane;formaldehyde?
The canonical SMILES for ethoxyethane;formaldehyde is C=O.CCOCC.CCOCC.
What is the InChIKey of ethoxyethane;formaldehyde?
The InChIKey is VDWFPMNKWDYLJV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H10O.CH2O/c2*1-3-5-4-2;1-2/h2*3-4H2,1-2H3;1H2.
What are the key properties of ethoxyethane;formaldehyde?
ethoxyethane;formaldehyde has a molecular weight of 178.27 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;formaldehyde is sourced from PubChem (CID 174286087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).