1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate

C10H16O4 — CID 173109179

IUPAC1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate
SMILESC=CC(=O)OC(C)OC(C)OC=CC
InChIInChI=1S/C10H16O4/c1-5-7-12-8(3)13-9(4)14-10(11)6-2/h5-9H,2H2,1,3-4H3
InChIKeyHEOAXVAUOSBZNY-UHFFFAOYSA-N
MW200.23 g/mol
LogP1.97
Rot. Bonds6

About 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate

1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate (PubChem CID 173109179) has the molecular formula C10H16O4 and a molecular weight of 200.23 g/mol. Its IUPAC name is 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate.

Molecular Properties

Compound Name1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate
PubChem CID173109179
Molecular FormulaC10H16O4
Molecular Weight200.23 g/mol
Exact Mass200.10
IUPAC Name1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate
SMILESC=CC(=O)OC(C)OC(C)OC=CC
InChIInChI=1S/C10H16O4/c1-5-7-12-8(3)13-9(4)14-10(11)6-2/h5-9H,2H2,1,3-4H3
InChIKeyHEOAXVAUOSBZNY-UHFFFAOYSA-N
XLogP1.97
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.23
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate
CID 18008699
1-[1-[1-(1-ethoxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate
CID 174987831
1-carbonochloridoyloxyethyl prop-2-enoate
CID 56990003
1-prop-2-enoyloxyethyl 2-chloropropanoate
CID 89183597
3-ethenoxybutan-2-yl prop-2-enoate
CID 141368584
(1-hydroxy-2-methylpropyl) prop-2-enoate
CID 23103213
1-dimethylarsanylethyl prop-2-enoate
CID 87979584
1-dimethoxyphosphoryloxyethyl prop-2-enoate
CID 21386963
1-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)ethyl prop-2-enoate
CID 154160428
4-methylpent-4-en-2-yl prop-2-enoate
CID 102248237
3,4-dimethylpent-3-en-2-yl prop-2-enoate
CID 175606841
2-prop-2-enoyloxypropyl (E)-but-2-enoate
CID 174502403

Frequently Asked Questions

What is the IUPAC name of 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate?
The IUPAC name of 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate (CID 173109179) is 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate.
What is the SMILES notation for 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate?
The canonical SMILES for 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate is C=CC(=O)OC(C)OC(C)OC=CC.
What is the InChIKey of 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate?
The InChIKey is HEOAXVAUOSBZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O4/c1-5-7-12-8(3)13-9(4)14-10(11)6-2/h5-9H,2H2,1,3-4H3.
What are the key properties of 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate?
1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate has a molecular weight of 200.23 g/mol, XLogP of 1.97, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-prop-1-enoxyethoxy)ethyl prop-2-enoate is sourced from PubChem (CID 173109179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).