Ethyl 5-methyl-3-oxohex-4-enoate

HCID 15564232
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Basic information

CAS
25556-51-8
Standard SMILES
CCOC(=O)CC(=O)C=C(C)C
InChIKey
RLMMKAOBTDTWMC-UHFFFAOYSA-N
Molecular formula
C9H14O3
Average molar mass
170.21 g/mol
Monoisotopic mass
170.0942943

Names & identifiers

Preferred name
Ethyl 5-methyl-3-oxohex-4-enoate
IUPAC
ethyl 5-methyl-3-oxohex-4-enoate

Names & synonyms

ETHYL 5-METHYL-3-OXOHEX-4-ENOATE25556-51-8SCHEMBL3109582DTXSID30574320RLMMKAOBTDTWMC-UHFFFAOYSA-NEthyl 5-methyl-3-oxo-4-hexenoate

Database identifiers

CAS
25556-51-8
PubChem CID
15564232
DTXSID
DTXSID30574320

Properties

Computed structural propertiesFilling in

XLogP
1.7
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
12

Related reactions

1 records
New reaction record

Compound notes

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