2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate

C14H28O8 — CID 87247613

IUPAC2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate
SMILESCCOCCOCCOCCOCCOCCOC(=O)OC
InChIInChI=1S/C14H28O8/c1-3-17-4-5-18-6-7-19-8-9-20-10-11-21-12-13-22-14(15)16-2/h3-13H2,1-2H3
InChIKeyNWRZKGBDZSPBGL-UHFFFAOYSA-N
MW324.37 g/mol
LogP0.87
Rot. Bonds16

About 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate

2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate (PubChem CID 87247613) has the molecular formula C14H28O8 and a molecular weight of 324.37 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate.

Molecular Properties

Compound Name2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate
PubChem CID87247613
Molecular FormulaC14H28O8
Molecular Weight324.37 g/mol
Exact Mass324.18
IUPAC Name2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate
SMILESCCOCCOCCOCCOCCOCCOC(=O)OC
InChIInChI=1S/C14H28O8/c1-3-17-4-5-18-6-7-19-8-9-20-10-11-21-12-13-22-14(15)16-2/h3-13H2,1-2H3
InChIKeyNWRZKGBDZSPBGL-UHFFFAOYSA-N
XLogP0.87
TPSA81.68 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.37
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

bis[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl] carbonate
CID 123756469
2-(2-chloroethoxy)ethyl methyl carbonate
CID 103970602
bis[2-(2-ethoxyethoxy)ethyl] propanedioate
CID 164851647
ethyl 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl carbonate
CID 87247724
carbonic acid;2-ethoxyethoxycarbonyloxy 2-ethoxyethyl carbonate
CID 159000036
methyl 2-(2-ethoxyethoxy)propanoate
CID 61234478
4-(2-methoxyethoxy)butyl methyl carbonate
CID 87247594
2-(2-ethoxyethoxy)ethyl (2S)-2-aminopropanoate
CID 167342621
1-ethoxy-2-(2-ethoxyethoxy)ethane;2-methoxyethyl acetate
CID 159055885
2-(2-ethoxybutoxy)ethyl methyl carbonate
CID 87247647
2-(2-ethoxyethoxy)ethoxymethanethioic S-acid
CID 87914074
2-[2-(2-ethoxyethoxy)ethoxy]ethyl carbonate
CID 131718681

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate?
The IUPAC name of 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate (CID 87247613) is 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate.
What is the SMILES notation for 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate?
The canonical SMILES for 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate is CCOCCOCCOCCOCCOCCOC(=O)OC.
What is the InChIKey of 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate?
The InChIKey is NWRZKGBDZSPBGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O8/c1-3-17-4-5-18-6-7-19-8-9-20-10-11-21-12-13-22-14(15)16-2/h3-13H2,1-2H3.
What are the key properties of 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate?
2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate has a molecular weight of 324.37 g/mol, XLogP of 0.87, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl methyl carbonate is sourced from PubChem (CID 87247613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).