Ethyl 2-acetyl-5-chlorohex-4-enoate

HCID 53723570CAS 26209-40-5
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Basic information

Standard SMILES
CCOC(=O)C(CC=C(C)Cl)C(C)=O
InChIKey
CIWYMZMDTIPDQL-UHFFFAOYSA-N
Molecular formula
C10H15ClO3
Average molar mass
218.68 g/mol
Monoisotopic mass
218.07097202

Names & identifiers

Preferred name
Ethyl 2-acetyl-5-chlorohex-4-enoate
IUPAC
ethyl 2-acetyl-5-chlorohex-4-enoate

Names & synonyms

26209-40-5ETHYL 2-ACETYL-5-CHLOROHEX-4-ENOATESCHEMBL11475788DTXSID30706200CIWYMZMDTIPDQL-UHFFFAOYSA-N3-Carboethoxy-6-chlorohept-5-en-2-one

Database identifiers

CAS
26209-40-5
PubChem CID
53723570
DTXSID
DTXSID30706200

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
14

Related reactions

4 records
New reaction record

Linked notes

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