2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid

C11H20O8 — CID 159631548

IUPAC2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid
SMILESC=C(CC(=O)O)C(=O)O.OCCOCCOCCO
InChIInChI=1S/C6H14O4.C5H6O4/c7-1-3-9-5-6-10-4-2-8;1-3(5(8)9)2-4(6)7/h7-8H,1-6H2;1-2H2,(H,6,7)(H,8,9)
InChIKeyMPEQDPIMAVAJCY-UHFFFAOYSA-N
MW280.27 g/mol
LogP-0.89
Rot. Bonds10

About 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid

2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid (PubChem CID 159631548) has the molecular formula C11H20O8 and a molecular weight of 280.27 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid
PubChem CID159631548
Molecular FormulaC11H20O8
Molecular Weight280.27 g/mol
Exact Mass280.12
IUPAC Name2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid
SMILESC=C(CC(=O)O)C(=O)O.OCCOCCOCCO
InChIInChI=1S/C6H14O4.C5H6O4/c7-1-3-9-5-6-10-4-2-8;1-3(5(8)9)2-4(6)7/h7-8H,1-6H2;1-2H2,(H,6,7)(H,8,9)
InChIKeyMPEQDPIMAVAJCY-UHFFFAOYSA-N
XLogP-0.89
TPSA133.52 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.27
LogP ≤ 5-0.89
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-methylprop-2-enoic acid
CID 88625291
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoic acid)
CID 173364076
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-methylprop-2-enoic acid
CID 88626217
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;2-methylprop-2-enoic acid
CID 87059902
acetic acid;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;2-methylprop-2-enoic acid
CID 175016263
potassium;sodium;hydride;2-methylidenebutanedioic acid
CID 174838643
2,2-bis(hydroxymethyl)propane-1,3-diol;2-[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol;bis(2-methylidenebutanedioic acid)
CID 174798732
ethenoxyethene;2-methylidenebutanedioic acid
CID 159680731
fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)
CID 160564072
acetylene;2-methylidenebutanedioic acid;urea
CID 157377951
2-methylidenebutanedioic acid;trimethylazanium;chloride
CID 157060052
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;prop-2-enoic acid
CID 88626214

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid?
The IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid (CID 159631548) is 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid is C=C(CC(=O)O)C(=O)O.OCCOCCOCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid?
The InChIKey is MPEQDPIMAVAJCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O4.C5H6O4/c7-1-3-9-5-6-10-4-2-8;1-3(5(8)9)2-4(6)7/h7-8H,1-6H2;1-2H2,(H,6,7)(H,8,9).
What are the key properties of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid?
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid has a molecular weight of 280.27 g/mol, XLogP of -0.89, 10 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-methylidenebutanedioic acid is sourced from PubChem (CID 159631548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).