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Ethyl 2-fluoro-3-methoxyphenylacetate

HCID 57728665
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)Cc1cccc(OC)c1F
InChIKey
BNQKZHRAUOLWJK-UHFFFAOYSA-N
Molecular formula
C11H13FO3
Average molar mass
212.22 g/mol
Monoisotopic mass
212.08487243

Names & identifiers

Preferred name
Ethyl 2-fluoro-3-methoxyphenylacetate
IUPAC
ethyl 2-(2-fluoro-3-methoxyphenyl)acetate

Names & synonyms

SCHEMBL13791160Ethyl 2-fluoro-3-methoxyphenylacetateAKOS021130295672931-82-7Z1544731886

Database identifiers

PubChem CID
57728665

Properties

Computed structural propertiesFilling in

XLogP
2.1
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
15
Formal charge
0
Complexity
208

Related reactions

1 records
New reaction record
HRID 2319624 reaction equation
HRID 2319624As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes