Ethyl 2-benzoylpent-4-ynoate

HCID 11009766
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Basic information

Standard SMILES
C#CCC(C(=O)OCC)C(=O)c1ccccc1
InChIKey
LXCDLPDPVLFZGQ-UHFFFAOYSA-N
Molecular formula
C14H14O3
Average molar mass
230.26 g/mol
Monoisotopic mass
230.0942943

Names & identifiers

Preferred name
Ethyl 2-benzoylpent-4-ynoate
IUPAC
ethyl 2-benzoylpent-4-ynoate

Names & synonyms

Ethyl 2-benzoylpent-4-ynoateethyl 2-benzoyl-pent-4-ynoateSCHEMBL8626351LXCDLPDPVLFZGQ-UHFFFAOYSA-Nethyl alpha-benzoyl-alpha-propargylacetateDB-170740Beta-oxo-alpha-2-propyn-1-ylbenzenepropanoic acid ethyl ester92190-57-3

Database identifiers

PubChem CID
11009766
Nikkaji
J1.113.774A

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
17

Related reactions

4 records
New reaction record

Linked notes

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