1-(2-ethoxyethoxy)-2-methoxyethane;methane

C9H24O3 — CID 162070739

IUPAC1-(2-ethoxyethoxy)-2-methoxyethane;methane
SMILESC.C.CCOCCOCCOC
InChIInChI=1S/C7H16O3.2CH4/c1-3-9-6-7-10-5-4-8-2;;/h3-7H2,1-2H3;2*1H4
InChIKeyZBAUFLKVDMPREN-UHFFFAOYSA-N
MW180.29 g/mol
LogP1.96
Rot. Bonds7

About 1-(2-ethoxyethoxy)-2-methoxyethane;methane

1-(2-ethoxyethoxy)-2-methoxyethane;methane (PubChem CID 162070739) has the molecular formula C9H24O3 and a molecular weight of 180.29 g/mol. Its IUPAC name is 1-(2-ethoxyethoxy)-2-methoxyethane;methane.

Molecular Properties

Compound Name1-(2-ethoxyethoxy)-2-methoxyethane;methane
PubChem CID162070739
Molecular FormulaC9H24O3
Molecular Weight180.29 g/mol
Exact Mass180.17
IUPAC Name1-(2-ethoxyethoxy)-2-methoxyethane;methane
SMILESC.C.CCOCCOCCOC
InChIInChI=1S/C7H16O3.2CH4/c1-3-9-6-7-10-5-4-8-2;;/h3-7H2,1-2H3;2*1H4
InChIKeyZBAUFLKVDMPREN-UHFFFAOYSA-N
XLogP1.96
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
CID 19982973
1,2-dimethoxyethane;1-ethoxy-2-(2-ethoxyethoxy)ethane
CID 159445382
bis(1-ethoxy-2-methoxyethane);hydrate
CID 88797439
carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane
CID 87519570
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1,2-dimethoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 159847962
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
CID 173303266
CID 173303266
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
CID 161321430
1-methoxy-2-(2-methoxyethoxy)ethane;tellane
CID 175355772
CID 172826348
CID 172826348
lithium bis(1-methoxy-2-(2-methoxyethoxy)ethane)
CID 5257331

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethoxy)-2-methoxyethane;methane?
The IUPAC name of 1-(2-ethoxyethoxy)-2-methoxyethane;methane (CID 162070739) is 1-(2-ethoxyethoxy)-2-methoxyethane;methane.
What is the SMILES notation for 1-(2-ethoxyethoxy)-2-methoxyethane;methane?
The canonical SMILES for 1-(2-ethoxyethoxy)-2-methoxyethane;methane is C.C.CCOCCOCCOC.
What is the InChIKey of 1-(2-ethoxyethoxy)-2-methoxyethane;methane?
The InChIKey is ZBAUFLKVDMPREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O3.2CH4/c1-3-9-6-7-10-5-4-8-2;;/h3-7H2,1-2H3;2*1H4.
What are the key properties of 1-(2-ethoxyethoxy)-2-methoxyethane;methane?
1-(2-ethoxyethoxy)-2-methoxyethane;methane has a molecular weight of 180.29 g/mol, XLogP of 1.96, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethoxy)-2-methoxyethane;methane is sourced from PubChem (CID 162070739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).