2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)

C12H22O7 — CID 160785980

IUPAC2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)
SMILESC=CC(=O)OC.C=CC(=O)OC.OCCOCCO
InChIInChI=1S/C4H10O3.2C4H6O2/c5-1-3-7-4-2-6;2*1-3-4(5)6-2/h5-6H,1-4H2;2*3H,1H2,2H3
InChIKeySBFBWIPQZLTKJA-UHFFFAOYSA-N
MW278.30 g/mol
LogP-0.32
Rot. Bonds6

About 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)

2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate) (PubChem CID 160785980) has the molecular formula C12H22O7 and a molecular weight of 278.30 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate).

Molecular Properties

Compound Name2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)
PubChem CID160785980
Molecular FormulaC12H22O7
Molecular Weight278.30 g/mol
Exact Mass278.14
IUPAC Name2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)
SMILESC=CC(=O)OC.C=CC(=O)OC.OCCOCCO
InChIInChI=1S/C4H10O3.2C4H6O2/c5-1-3-7-4-2-6;2*1-3-4(5)6-2/h5-6H,1-4H2;2*3H,1H2,2H3
InChIKeySBFBWIPQZLTKJA-UHFFFAOYSA-N
XLogP-0.32
TPSA102.29 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.30
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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-ethoxyethoxy)ethanol;methyl prop-2-enoate
CID 159658370
1-[2-(2-hydroxyethoxy)ethoxy]butan-2-ol;methyl prop-2-enoate
CID 158671182
bis(methyl prop-2-enoate);propane
CID 160610529
formaldehyde;bis(methyl prop-2-enoate)
CID 174834920
1-butoxy-2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl prop-2-enoate
CID 158731688
2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)
CID 161223084
tris(2-(2-hydroxyethoxy)ethanol);prop-2-enoic acid
CID 173161681
N-methylmethanamine;methyl prop-2-enoate
CID 160519545
methyl prop-2-enoate;zinc;hydroiodide
CID 174920800
ethane-1,1,2-triol;methyl prop-2-enoate
CID 161139379
ethane-1,2-diol;methyl prop-2-enoate;bis(2-methylprop-2-enoic acid)
CID 175208053
dimethoxymethane;methyl prop-2-enoate
CID 162245850

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)?
The IUPAC name of 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate) (CID 160785980) is 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate).
What is the SMILES notation for 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)?
The canonical SMILES for 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate) is C=CC(=O)OC.C=CC(=O)OC.OCCOCCO.
What is the InChIKey of 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)?
The InChIKey is SBFBWIPQZLTKJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O3.2C4H6O2/c5-1-3-7-4-2-6;2*1-3-4(5)6-2/h5-6H,1-4H2;2*3H,1H2,2H3.
What are the key properties of 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate)?
2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate) has a molecular weight of 278.30 g/mol, XLogP of -0.32, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)ethanol;bis(methyl prop-2-enoate) is sourced from PubChem (CID 160785980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).