2-(2-methoxyethoxy)ethoxymethyl acetate

C8H16O5 — CID 87088322

IUPAC2-(2-methoxyethoxy)ethoxymethyl acetate
SMILESCOCCOCCOCOC(C)=O
InChIInChI=1S/C8H16O5/c1-8(9)13-7-12-6-5-11-4-3-10-2/h3-7H2,1-2H3
InChIKeyNSKJXNZYSUBJGA-UHFFFAOYSA-N
MW192.21 g/mol
LogP0.19
Rot. Bonds8

About 2-(2-methoxyethoxy)ethoxymethyl acetate

2-(2-methoxyethoxy)ethoxymethyl acetate (PubChem CID 87088322) has the molecular formula C8H16O5 and a molecular weight of 192.21 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)ethoxymethyl acetate.

Molecular Properties

Compound Name2-(2-methoxyethoxy)ethoxymethyl acetate
PubChem CID87088322
Molecular FormulaC8H16O5
Molecular Weight192.21 g/mol
Exact Mass192.10
IUPAC Name2-(2-methoxyethoxy)ethoxymethyl acetate
SMILESCOCCOCCOCOC(C)=O
InChIInChI=1S/C8H16O5/c1-8(9)13-7-12-6-5-11-4-3-10-2/h3-7H2,1-2H3
InChIKeyNSKJXNZYSUBJGA-UHFFFAOYSA-N
XLogP0.19
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-ethoxy-2-(2-ethoxyethoxy)ethane;2-methoxyethyl acetate
CID 159055885
2-methoxyethoxymethyl ethaneperoxoate
CID 22938292
4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butan-2-one
CID 71329199
4-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butan-2-one
CID 153276611
1-(2-butoxyethoxy)butane;2-methoxyethyl acetate
CID 90456855
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
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
butan-2-one;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 161208459
1,2-dimethoxyethane;ethyl acetate
CID 87198031
bis[2-(2-methoxyethoxy)ethyl] (Z)-2,3-dimethylbut-2-enedioate
CID 58362019
4-(acetyloxymethoxy)butanoic acid
CID 90487624

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)ethoxymethyl acetate?
The IUPAC name of 2-(2-methoxyethoxy)ethoxymethyl acetate (CID 87088322) is 2-(2-methoxyethoxy)ethoxymethyl acetate.
What is the SMILES notation for 2-(2-methoxyethoxy)ethoxymethyl acetate?
The canonical SMILES for 2-(2-methoxyethoxy)ethoxymethyl acetate is COCCOCCOCOC(C)=O.
What is the InChIKey of 2-(2-methoxyethoxy)ethoxymethyl acetate?
The InChIKey is NSKJXNZYSUBJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O5/c1-8(9)13-7-12-6-5-11-4-3-10-2/h3-7H2,1-2H3.
What are the key properties of 2-(2-methoxyethoxy)ethoxymethyl acetate?
2-(2-methoxyethoxy)ethoxymethyl acetate has a molecular weight of 192.21 g/mol, XLogP of 0.19, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)ethoxymethyl acetate is sourced from PubChem (CID 87088322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).