8-prop-2-enoyloxyoctyl prop-2-enoate

C14H22O4 — CID 12934232

IUPAC8-prop-2-enoyloxyoctyl prop-2-enoate
SMILESC=CC(=O)OCCCCCCCCOC(=O)C=C
InChIInChI=1S/C14H22O4/c1-3-13(15)17-11-9-7-5-6-8-10-12-18-14(16)4-2/h3-4H,1-2,5-12H2
InChIKeyIHNQLRURNALWRJ-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.79
Rot. Bonds11

About 8-prop-2-enoyloxyoctyl prop-2-enoate

8-prop-2-enoyloxyoctyl prop-2-enoate (PubChem CID 12934232) has the molecular formula C14H22O4 and a molecular weight of 254.33 g/mol. Its IUPAC name is 8-prop-2-enoyloxyoctyl prop-2-enoate.

Molecular Properties

Compound Name8-prop-2-enoyloxyoctyl prop-2-enoate
PubChem CID12934232
Molecular FormulaC14H22O4
Molecular Weight254.33 g/mol
Exact Mass254.15
IUPAC Name8-prop-2-enoyloxyoctyl prop-2-enoate
SMILESC=CC(=O)OCCCCCCCCOC(=O)C=C
InChIInChI=1S/C14H22O4/c1-3-13(15)17-11-9-7-5-6-8-10-12-18-14(16)4-2/h3-4H,1-2,5-12H2
InChIKeyIHNQLRURNALWRJ-UHFFFAOYSA-N
XLogP2.79
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.79
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'}

Analyze 8-prop-2-enoyloxyoctyl 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

Related Compounds

4-prop-2-enoyloxybutyl prop-2-enoate;6-prop-2-enoyloxyhexyl prop-2-enoate
CID 158256375
10-hydroxydecyl prop-2-enoate
CID 14715958
11-hydroxyundecyl prop-2-enoate
CID 54223498
19-hydroxynonadecyl prop-2-enoate
CID 20625688
12-hydroxydodecyl prop-2-enoate
CID 19859974
azane;3-prop-2-enoyloxypropyl prop-2-enoate
CID 162679005
docosyl prop-2-enoate;henicosyl prop-2-enoate;icosyl prop-2-enoate;tetracosyl prop-2-enoate;tricosyl prop-2-enoate
CID 159127322
14-fluorotetradecyl prop-2-enoate
CID 142675259
11-fluoroundecyl prop-2-enoate
CID 88673047
pentatriacontyl prop-2-enoate
CID 141309454
docosyl prop-2-enoate;henicosyl prop-2-enoate;tetracosyl prop-2-enoate;tricosyl prop-2-enoate
CID 161245650
[(E)-20-prop-2-enoyloxyicos-10-enyl] prop-2-enoate
CID 101145209

Frequently Asked Questions

What is the IUPAC name of 8-prop-2-enoyloxyoctyl prop-2-enoate?
The IUPAC name of 8-prop-2-enoyloxyoctyl prop-2-enoate (CID 12934232) is 8-prop-2-enoyloxyoctyl prop-2-enoate.
What is the SMILES notation for 8-prop-2-enoyloxyoctyl prop-2-enoate?
The canonical SMILES for 8-prop-2-enoyloxyoctyl prop-2-enoate is C=CC(=O)OCCCCCCCCOC(=O)C=C.
What is the InChIKey of 8-prop-2-enoyloxyoctyl prop-2-enoate?
The InChIKey is IHNQLRURNALWRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O4/c1-3-13(15)17-11-9-7-5-6-8-10-12-18-14(16)4-2/h3-4H,1-2,5-12H2.
What are the key properties of 8-prop-2-enoyloxyoctyl prop-2-enoate?
8-prop-2-enoyloxyoctyl prop-2-enoate has a molecular weight of 254.33 g/mol, XLogP of 2.79, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-prop-2-enoyloxyoctyl prop-2-enoate is sourced from PubChem (CID 12934232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).