2-ethoxyethyl 2-ethoxybutanoate

C10H20O4 — CID 88671888

IUPAC2-ethoxyethyl 2-ethoxybutanoate
SMILESCCOCCOC(=O)C(CC)OCC
InChIInChI=1S/C10H20O4/c1-4-9(13-6-3)10(11)14-8-7-12-5-2/h9H,4-8H2,1-3H3
InChIKeyTUSALZKJAVZCRR-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.38
Rot. Bonds8

About 2-ethoxyethyl 2-ethoxybutanoate

2-ethoxyethyl 2-ethoxybutanoate (PubChem CID 88671888) has the molecular formula C10H20O4 and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-ethoxyethyl 2-ethoxybutanoate.

Molecular Properties

Compound Name2-ethoxyethyl 2-ethoxybutanoate
PubChem CID88671888
Molecular FormulaC10H20O4
Molecular Weight204.27 g/mol
Exact Mass204.14
IUPAC Name2-ethoxyethyl 2-ethoxybutanoate
SMILESCCOCCOC(=O)C(CC)OCC
InChIInChI=1S/C10H20O4/c1-4-9(13-6-3)10(11)14-8-7-12-5-2/h9H,4-8H2,1-3H3
InChIKeyTUSALZKJAVZCRR-UHFFFAOYSA-N
XLogP1.38
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxyethyl 2-ethoxybutanoate;prop-2-enoic acid
CID 88671887
amino 2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]butanoate
CID 54098191
2-ethoxybutanoyl 2-ethoxybutanoate
CID 87083983
2-ethoxyethyl (2R)-2-methylbutanoate
CID 59033497
2-(2-ethoxyethoxy)ethyl (2S)-2-aminopropanoate
CID 167342621
2-ethoxyethyl 2-amino-3-methylbutanoate
CID 61276999
ethyl 2-(3,3-dimethylbutoxy)butanoate
CID 66232205
bis[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl] carbonate
CID 123756469
2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate
CID 87247613
[3-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-methyl-3-oxopropyl] 2-methylbutanoate
CID 131967149
2-ethoxyethyl 2,3,3-trimethylbutanoate
CID 87160003
methyl 2-(2-ethoxyethoxy)propanoate
CID 61234478

Frequently Asked Questions

What is the IUPAC name of 2-ethoxyethyl 2-ethoxybutanoate?
The IUPAC name of 2-ethoxyethyl 2-ethoxybutanoate (CID 88671888) is 2-ethoxyethyl 2-ethoxybutanoate.
What is the SMILES notation for 2-ethoxyethyl 2-ethoxybutanoate?
The canonical SMILES for 2-ethoxyethyl 2-ethoxybutanoate is CCOCCOC(=O)C(CC)OCC.
What is the InChIKey of 2-ethoxyethyl 2-ethoxybutanoate?
The InChIKey is TUSALZKJAVZCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O4/c1-4-9(13-6-3)10(11)14-8-7-12-5-2/h9H,4-8H2,1-3H3.
What are the key properties of 2-ethoxyethyl 2-ethoxybutanoate?
2-ethoxyethyl 2-ethoxybutanoate has a molecular weight of 204.27 g/mol, XLogP of 1.38, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxyethyl 2-ethoxybutanoate is sourced from PubChem (CID 88671888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).