chempirical

Ethyl N-formylglycinate

C5H9NO3CAS 3154-51-6131.13 g/mol

Open in Covalent MOL file
OONHO
Ester

Properties

Molecular formula
C5H9NO3
Molar mass
131.13 g/mol
Exact mass
131.0582 Da
Boiling point
119–120 °C (at 1 Torr)
logP
0.14Crippen estimate
Polar surface area
58.9 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Identifiers

CAS number
3154-51-6
SMILES
CCOC(=O)CN=CO
InChIKey
GMBCCEOJUWMBPF-UHFFFAOYSA-N
InChI
InChI=1S/C5H9NO3/c1-2-9-5(8)3-6-4-7/h4H,2-3H2,1H3,(H,6,7)

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Names and synonyms

7 names
  • Glycine, N-formyl-, ethyl ester
  • N-Formylglycine ethyl ester
  • Ethyl formamidoacetate
  • Ethyl formylaminoacetate
  • NSC 14440
  • Dephenethylleccinine A
  • 2-Formylaminoacetic acid ethyl ester

Work with Ethyl N-formylglycinate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl 2-methoxyacetate3938-96-352 % similar Ethyl acetamidoacetate1906-82-751 % similar Ethyl isocyanatoacetate2949-22-650 % similar Ethyl 2-isothiocyanatoacetate24066-82-849 % similar Ethyl azidoacetate637-81-049 % similar Ethyl glycolate623-50-748 % similar Ethyl ethoxyacetate817-95-848 % similar Diethyl malonate105-53-348 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Aminolevulinic acid106-60-5 (S)-Morpholine-3-carboxylic acid106825-79-0 N-Acetylalanine1115-69-1 3-Aminotetrahydrofuran-3-carboxylic acid125218-55-5 N-Acetyl-D-alanine19436-52-3 cis-4-Hydroxy-D-proline2584-71-6 Acetyl-β-alanine3025-95-4 trans-3-Hydroxy-L-proline4298-08-2

Elsewhere

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