About 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate
1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate (PubChem CID 18008699) has the molecular formula C10H14O5
and a molecular weight of 214.22 g/mol. Its IUPAC name is 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate.
Molecular Properties
| Compound Name | 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate |
| PubChem CID | 18008699 |
| Molecular Formula | C10H14O5 |
| Molecular Weight | 214.22 g/mol |
| Exact Mass | 214.08 |
| IUPAC Name | 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate |
| SMILES | C=CC(=O)OC(C)OC(C)OC(=O)C=C |
| InChI | InChI=1S/C10H14O5/c1-5-9(11)14-7(3)13-8(4)15-10(12)6-2/h5-8H,1-2H2,3-4H3 |
| InChIKey | IMTMFTPWOXTLAV-UHFFFAOYSA-N |
| XLogP | 1.15 |
| TPSA | 61.83 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.22 |
| LogP ≤ 5 | 1.15 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'} |
|---|
Analyze 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate?
The IUPAC name of 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate (CID 18008699) is 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate.
What is the SMILES notation for 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate?
The canonical SMILES for 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate is C=CC(=O)OC(C)OC(C)OC(=O)C=C.
What is the InChIKey of 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate?
The InChIKey is IMTMFTPWOXTLAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O5/c1-5-9(11)14-7(3)13-8(4)15-10(12)6-2/h5-8H,1-2H2,3-4H3.
What are the key properties of 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate?
1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate has a molecular weight of 214.22 g/mol, XLogP of 1.15, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate is sourced from PubChem (CID 18008699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).