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Methyl 2-(2-fluorophenyl)-2-(phenylamino)acetate

HCID 54889983
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Basic information

Standard SMILES
COC(=O)C(Nc1ccccc1)c1ccccc1F
InChIKey
IIAFQXSDVRKTMR-UHFFFAOYSA-N
Molecular formula
C15H14FNO2
Average molar mass
259.27 g/mol
Monoisotopic mass
259.10085685

Names & identifiers

Preferred name
Methyl 2-(2-fluorophenyl)-2-(phenylamino)acetate
IUPAC
methyl 2-anilino-2-(2-fluorophenyl)acetate

Names & synonyms

methyl 2-(2-fluorophenyl)-2-(phenylamino)acetate1218019-39-6SCHEMBL2487574SCHEMBL13241025IIAFQXSDVRKTMR-UHFFFAOYSA-NAKOS005797324EN300-6510365(2-fluoro-phenyl)-phenylamino-acetic acid methyl ester

Database identifiers

PubChem CID
54889983

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
19
Formal charge
0
Complexity
292

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Related reactions

3 records
New reaction record
HRID 77058 reaction equation
HRID 77058As productuspto-grants-2014_09
HRID 139017 reaction equation
HRID 139017As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1255091 reaction equation
HRID 1255091As productuspto-grants-2013_06

Compound notes

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