ethenoxyethene;propyl prop-2-enoate

C10H16O3 — CID 174744389

IUPACethenoxyethene;propyl prop-2-enoate
SMILESC=CC(=O)OCCC.C=COC=C
InChIInChI=1S/C6H10O2.C4H6O/c1-3-5-8-6(7)4-2;1-3-5-4-2/h4H,2-3,5H2,1H3;3-4H,1-2H2
InChIKeyDKNOUOMJNZSQJZ-UHFFFAOYSA-N
MW184.23 g/mol
LogP2.42
Rot. Bonds5

About ethenoxyethene;propyl prop-2-enoate

ethenoxyethene;propyl prop-2-enoate (PubChem CID 174744389) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is ethenoxyethene;propyl prop-2-enoate.

Molecular Properties

Compound Nameethenoxyethene;propyl prop-2-enoate
PubChem CID174744389
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Nameethenoxyethene;propyl prop-2-enoate
SMILESC=CC(=O)OCCC.C=COC=C
InChIInChI=1S/C6H10O2.C4H6O/c1-3-5-8-6(7)4-2;1-3-5-4-2/h4H,2-3,5H2,1H3;3-4H,1-2H2
InChIKeyDKNOUOMJNZSQJZ-UHFFFAOYSA-N
XLogP2.42
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

carbamic acid;propyl prop-2-enoate
CID 87571569
pentyl prop-2-enoate;propyl prop-2-enoate
CID 175293000
N-propan-2-ylpropan-2-amine;propyl prop-2-enoate
CID 175325942
N,N-di(propan-2-yl)propan-2-amine;propyl prop-2-enoate
CID 146373089
propan-2-yl prop-2-enoate;propyl prop-2-enoate
CID 19001097
dimethoxy(propyl)silane;propyl prop-2-enoate
CID 174852514
heptadecyl prop-2-enoate;hexadecyl prop-2-enoate;octadecyl prop-2-enoate;pentadecyl prop-2-enoate;tetradecyl prop-2-enoate;tridecyl prop-2-enoate
CID 159575283
pentatriacontyl prop-2-enoate
CID 141309454
docosyl prop-2-enoate;henicosyl prop-2-enoate;tetracosyl prop-2-enoate;tricosyl prop-2-enoate
CID 161245650
hexyl prop-2-enoate
CID 17259
docosyl prop-2-enoate;henicosyl prop-2-enoate;icosyl prop-2-enoate;tetracosyl prop-2-enoate;tricosyl prop-2-enoate
CID 159127322
heptadecyl prop-2-enoate;hexadecyl prop-2-enoate;octadecyl prop-2-enoate;pentadecyl prop-2-enoate;tetradecyl prop-2-enoate
CID 159699669

Frequently Asked Questions

What is the IUPAC name of ethenoxyethene;propyl prop-2-enoate?
The IUPAC name of ethenoxyethene;propyl prop-2-enoate (CID 174744389) is ethenoxyethene;propyl prop-2-enoate.
What is the SMILES notation for ethenoxyethene;propyl prop-2-enoate?
The canonical SMILES for ethenoxyethene;propyl prop-2-enoate is C=CC(=O)OCCC.C=COC=C.
What is the InChIKey of ethenoxyethene;propyl prop-2-enoate?
The InChIKey is DKNOUOMJNZSQJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O2.C4H6O/c1-3-5-8-6(7)4-2;1-3-5-4-2/h4H,2-3,5H2,1H3;3-4H,1-2H2.
What are the key properties of ethenoxyethene;propyl prop-2-enoate?
ethenoxyethene;propyl prop-2-enoate has a molecular weight of 184.23 g/mol, XLogP of 2.42, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenoxyethene;propyl prop-2-enoate is sourced from PubChem (CID 174744389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).