chempirical

N-(2,4-Dinitrophenyl)-L-serine

C9H9N3O7CAS 1655-64-7271.19 g/mol

Open in Covalent MOL file
OHOHOHNN+OO−N+OO−
AlcoholCarboxylic acidNitroSecondary amine

Properties

Molecular formula
C9H9N3O7
Molar mass
271.19 g/mol
Exact mass
271.0440 Da
Melting point
196–197 °C
logP
0.36Crippen estimate
Polar surface area
155.8 Ų
H-bond donors / acceptors
3 / 7
Rotatable bonds
6
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
1655-64-7
SMILES
O=C(O)[C@H](CO)Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]
InChIKey
SBQZBOCQYMVLTC-ZETCQYMHSA-N
InChI
InChI=1S/C9H9N3O7/c13-4-7(9(14)15)10-6-2-1-5(11(16)17)3-8(6)12(18)19/h1-3,7,10,13H,4H2,(H,14,15)/t7-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

10 names
  • L-Serine, N-(2,4-dinitrophenyl)-
  • Serine, N-(2,4-dinitrophenyl)-, L-
  • 2,4-Dinitrophenyl-L-serine
  • (2,4-Dinitrophenyl)serine
  • N-(2,4-Dinitrophenyl)serine
  • N-2,4-DNP-L-serine
  • DNP-L-serine
  • L-DNP-Serine
  • NSC 89606
  • (2S)-2-[(2,4-Dinitrophenyl)amino]-3-hydroxypropanoic acid

Work with N-(2,4-Dinitrophenyl)-L-serine

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

2,4-Dinitrophenyl-L-alanine1655-52-367 % similar N-(2,4-Dinitrophenyl)-L-valine1694-97-965 % similar N-(2,4-Dinitrophenyl)glycine1084-76-055 % similar 2-[(2,4-Dinitrophenyl)amino]ethanol1945-92-252 % similar Dinitrophenyl-ε-aminocaproic acid10466-72-549 % similar 1-(2,4-Dinitrophenyl)-L-proline1655-55-648 % similar Disperse yellow 1119-15-348 % similar 2,4-Dinitrophenylacetic acid643-43-646 % similar

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

Same formula

3,5-Dinitro-L-tyrosine17360-11-1

Elsewhere

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