2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate

C10H16O7 — CID 59844671

IUPAC2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate
SMILESCCOCCOC(=O)COCC1COC(=O)O1
InChIInChI=1S/C10H16O7/c1-2-13-3-4-15-9(11)7-14-5-8-6-16-10(12)17-8/h8H,2-7H2,1H3
InChIKeyFLNBNDLRCFLONS-UHFFFAOYSA-N
MW248.23 g/mol
LogP0.12
Rot. Bonds8

About 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate

2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate (PubChem CID 59844671) has the molecular formula C10H16O7 and a molecular weight of 248.23 g/mol. Its IUPAC name is 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate.

Molecular Properties

Compound Name2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate
PubChem CID59844671
Molecular FormulaC10H16O7
Molecular Weight248.23 g/mol
Exact Mass248.09
IUPAC Name2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate
SMILESCCOCCOC(=O)COCC1COC(=O)O1
InChIInChI=1S/C10H16O7/c1-2-13-3-4-15-9(11)7-14-5-8-6-16-10(12)17-8/h8H,2-7H2,1H3
InChIKeyFLNBNDLRCFLONS-UHFFFAOYSA-N
XLogP0.12
TPSA80.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.23
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

(2-oxo-1,3-dioxolan-4-yl)methyl 2-methoxyacetate
CID 14765868
(2-oxo-1,3-dioxolan-4-yl)methoxycarbonyl propanoate
CID 150514849
bis[(2-oxo-1,3-dioxolan-4-yl)methyl] pentanedioate
CID 59449201
(2-oxo-1,3-dioxolan-4-yl)methyl 3-oxobutanoate
CID 157036865
[(4S)-2-oxo-1,3-dioxolan-4-yl]methyl dodecanoate
CID 10334978
[2-oxo-2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]ethyl] 2,2-dimethylpentanoate
CID 159032301
4-(oxiran-2-ylmethoxymethyl)-1,3-dioxolan-2-one
CID 13170397
2-[2-(2-ethoxyacetyl)oxyethoxy]ethyl 2-ethoxyacetate
CID 121008376
(4S)-4-[3-[hydroxy(methyl)amino]propoxymethyl]-1,3-dioxolan-2-one
CID 163561102
ethane;(2-oxo-1,3-dioxolan-4-yl)methyl N-methylcarbamate
CID 145367345
2-[(2-oxo-1,3-dioxolan-4-yl)methoxycarbonyloxy]ethyl 2-methylprop-2-enoate
CID 22381518
(2-oxo-1,3-dioxolan-4-yl)methyl 2,2-difluoroacetate
CID 87396873

Frequently Asked Questions

What is the IUPAC name of 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate?
The IUPAC name of 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate (CID 59844671) is 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate.
What is the SMILES notation for 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate?
The canonical SMILES for 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate is CCOCCOC(=O)COCC1COC(=O)O1.
What is the InChIKey of 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate?
The InChIKey is FLNBNDLRCFLONS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O7/c1-2-13-3-4-15-9(11)7-14-5-8-6-16-10(12)17-8/h8H,2-7H2,1H3.
What are the key properties of 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate?
2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate has a molecular weight of 248.23 g/mol, XLogP of 0.12, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxyethyl 2-[(2-oxo-1,3-dioxolan-4-yl)methoxy]acetate is sourced from PubChem (CID 59844671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).