2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate

C10H16O4 — CID 67660122

IUPAC2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCOC1CCCO1
InChIInChI=1S/C10H16O4/c1-8(2)10(11)14-7-6-13-9-4-3-5-12-9/h9H,1,3-7H2,2H3
InChIKeyCHRMKNAJRPJMDG-UHFFFAOYSA-N
MW200.23 g/mol
LogP1.26
Rot. Bonds5

About 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate

2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate (PubChem CID 67660122) has the molecular formula C10H16O4 and a molecular weight of 200.23 g/mol. Its IUPAC name is 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate
PubChem CID67660122
Molecular FormulaC10H16O4
Molecular Weight200.23 g/mol
Exact Mass200.10
IUPAC Name2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCOC1CCCO1
InChIInChI=1S/C10H16O4/c1-8(2)10(11)14-7-6-13-9-4-3-5-12-9/h9H,1,3-7H2,2H3
InChIKeyCHRMKNAJRPJMDG-UHFFFAOYSA-N
XLogP1.26
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 51.26
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate?
The IUPAC name of 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate (CID 67660122) is 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCOC1CCCO1.
What is the InChIKey of 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate?
The InChIKey is CHRMKNAJRPJMDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O4/c1-8(2)10(11)14-7-6-13-9-4-3-5-12-9/h9H,1,3-7H2,2H3.
What are the key properties of 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate?
2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate has a molecular weight of 200.23 g/mol, XLogP of 1.26, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yloxy)ethyl 2-methylprop-2-enoate is sourced from PubChem (CID 67660122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).