carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane

C8H18O6 — CID 87519570

IUPACcarbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane
SMILESCCOCCOCCOC.O=C(O)O
InChIInChI=1S/C7H16O3.CH2O3/c1-3-9-6-7-10-5-4-8-2;2-1(3)4/h3-7H2,1-2H3;(H2,2,3,4)
InChIKeyBMUAQMZCTQPQHY-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.91
Rot. Bonds7

About carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane

carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane (PubChem CID 87519570) has the molecular formula C8H18O6 and a molecular weight of 210.23 g/mol. Its IUPAC name is carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane.

Molecular Properties

Compound Namecarbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane
PubChem CID87519570
Molecular FormulaC8H18O6
Molecular Weight210.23 g/mol
Exact Mass210.11
IUPAC Namecarbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane
SMILESCCOCCOCCOC.O=C(O)O
InChIInChI=1S/C7H16O3.CH2O3/c1-3-9-6-7-10-5-4-8-2;2-1(3)4/h3-7H2,1-2H3;(H2,2,3,4)
InChIKeyBMUAQMZCTQPQHY-UHFFFAOYSA-N
XLogP0.91
TPSA85.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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
1-(2-ethoxyethoxy)-2-methoxyethane;methane
CID 162070739
bis(1-ethoxy-2-methoxyethane);hydrate
CID 88797439
1-ethoxy-2-(2-ethoxyethoxy)ethane;2-methoxyethyl acetate
CID 159055885
carbonic acid;1-(2-hydroperoxyethoxy)-2-methoxyethane
CID 118305943
2-ethoxyethyl 2-[2-(2-methoxyethoxy)ethoxy]acetate
CID 175750178
ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87301416
ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol
CID 138488183
3-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 155128339
5-(2-ethoxyethoxy)-2-methylidenepentanoic acid;5-(2-methoxyethoxy)-2-methylidenepentanoic acid
CID 87657263
2-ethoxyethyl propanoate;2-methoxyethyl propanoate
CID 87828921

Frequently Asked Questions

What is the IUPAC name of carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane?
The IUPAC name of carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane (CID 87519570) is carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane.
What is the SMILES notation for carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane?
The canonical SMILES for carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane is CCOCCOCCOC.O=C(O)O.
What is the InChIKey of carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane?
The InChIKey is BMUAQMZCTQPQHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O3.CH2O3/c1-3-9-6-7-10-5-4-8-2;2-1(3)4/h3-7H2,1-2H3;(H2,2,3,4).
What are the key properties of carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane?
carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane has a molecular weight of 210.23 g/mol, XLogP of 0.91, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;1-(2-ethoxyethoxy)-2-methoxyethane is sourced from PubChem (CID 87519570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).