2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid

C8H12O5 — CID 23168599

IUPAC2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid
SMILESC=C(C)C(=O)OCCOCC(=O)O
InChIInChI=1S/C8H12O5/c1-6(2)8(11)13-4-3-12-5-7(9)10/h1,3-5H2,2H3,(H,9,10)
InChIKeyBLSCWACAKUHBOC-UHFFFAOYSA-N
MW188.18 g/mol
LogP0.21
Rot. Bonds6

About 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid

2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid (PubChem CID 23168599) has the molecular formula C8H12O5 and a molecular weight of 188.18 g/mol. Its IUPAC name is 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid.

Molecular Properties

Compound Name2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid
PubChem CID23168599
Molecular FormulaC8H12O5
Molecular Weight188.18 g/mol
Exact Mass188.07
IUPAC Name2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid
SMILESC=C(C)C(=O)OCCOCC(=O)O
InChIInChI=1S/C8H12O5/c1-6(2)8(11)13-4-3-12-5-7(9)10/h1,3-5H2,2H3,(H,9,10)
InChIKeyBLSCWACAKUHBOC-UHFFFAOYSA-N
XLogP0.21
TPSA72.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 7979
2-[2-[2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 18762112
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 139628547
bis(2-methylprop-2-enoic acid);2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethyl 2-methylprop-2-enoate
CID 158009828
ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 22918033
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 162171139
ethane;methoxyethane;2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 21465850
2-(2-aminoethoxy)ethyl 2-methylprop-2-enoate
CID 20573934
2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 19001742
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 23189778
acetyl 2-methylprop-2-enoate;2-[2-(2-hydroxyethoxy)ethoxy]acetic acid
CID 174807488

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid?
The IUPAC name of 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid (CID 23168599) is 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid.
What is the SMILES notation for 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid?
The canonical SMILES for 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid is C=C(C)C(=O)OCCOCC(=O)O.
What is the InChIKey of 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid?
The InChIKey is BLSCWACAKUHBOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O5/c1-6(2)8(11)13-4-3-12-5-7(9)10/h1,3-5H2,2H3,(H,9,10).
What are the key properties of 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid?
2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid has a molecular weight of 188.18 g/mol, XLogP of 0.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methylprop-2-enoyloxy)ethoxy]acetic acid is sourced from PubChem (CID 23168599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).