1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate

C9H18O7-2 — CID 23366578

IUPAC1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate
SMILESCOCCOCCOCCOC.O=C([O-])[O-]
InChIInChI=1S/C8H18O4.CH2O3/c1-9-3-5-11-7-8-12-6-4-10-2;2-1(3)4/h3-8H2,1-2H3;(H2,2,3,4)/p-2
InChIKeyUNICICJWJJXZKV-UHFFFAOYSA-L
MW238.24 g/mol
LogP-2.13
Rot. Bonds9

About 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate

1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate (PubChem CID 23366578) has the molecular formula C9H18O7-2 and a molecular weight of 238.24 g/mol. Its IUPAC name is 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate.

Molecular Properties

Compound Name1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate
PubChem CID23366578
Molecular FormulaC9H18O7-2
Molecular Weight238.24 g/mol
Exact Mass238.11
IUPAC Name1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate
SMILESCOCCOCCOCCOC.O=C([O-])[O-]
InChIInChI=1S/C8H18O4.CH2O3/c1-9-3-5-11-7-8-12-6-4-10-2;2-1(3)4/h3-8H2,1-2H3;(H2,2,3,4)/p-2
InChIKeyUNICICJWJJXZKV-UHFFFAOYSA-L
XLogP-2.13
TPSA100.11 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 5-2.13
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

disodium;1,2-dimethoxyethane;carbonate
CID 86669059
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
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
CID 161321430
CID 173303266
CID 173303266
CID 172826348
CID 172826348
lithium bis(1-methoxy-2-(2-methoxyethoxy)ethane)
CID 5257331
1-methoxy-2-(2-methoxyethoxy)ethane;tellane
CID 175355772
ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87301416
bis(2-methoxyethylazanium);carbonate
CID 141135297
butan-2-one;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 161208459

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate?
The IUPAC name of 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate (CID 23366578) is 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate.
What is the SMILES notation for 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate?
The canonical SMILES for 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate is COCCOCCOCCOC.O=C([O-])[O-].
What is the InChIKey of 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate?
The InChIKey is UNICICJWJJXZKV-UHFFFAOYSA-L. The full InChI is InChI=1S/C8H18O4.CH2O3/c1-9-3-5-11-7-8-12-6-4-10-2;2-1(3)4/h3-8H2,1-2H3;(H2,2,3,4)/p-2.
What are the key properties of 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate?
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate has a molecular weight of 238.24 g/mol, XLogP of -2.13, 9 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane carbonate is sourced from PubChem (CID 23366578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).