chempirical

N-(2,4-Dinitrophenyl)glycine

C8H7N3O6CAS 1084-76-0241.16 g/mol

Open in Covalent MOL file
OHOHNN+OO−N+OO−
Carboxylic acidNitroSecondary amine

Properties

Molecular formula
C8H7N3O6
Molar mass
241.16 g/mol
Exact mass
241.0335 Da
Melting point
205 °C
logP
1.00Crippen estimate
Polar surface area
135.6 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
5

Identifiers

CAS number
1084-76-0
SMILES
O=C(O)CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]
InChIKey
RQPREKYEHBAOAR-UHFFFAOYSA-N
InChI
InChI=1S/C8H7N3O6/c12-8(13)4-9-6-2-1-5(10(14)15)3-7(6)11(16)17/h1-3,9H,4H2,(H,12,13)

Weigh it out

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

Names and synonyms

8 names
  • Glycine, N-(2,4-dinitrophenyl)-
  • 2,4-Dinitrophenylglycine
  • Nα-2,4-dinitrophenylglycine
  • N-2,4-DNP-glycine
  • DNP-glycine
  • NSC 37410
  • 2-(2,4-Dinitroanilino)acetic acid
  • 2-[(2,4-Dinitrophenyl)amino]acetic acid

Work with N-(2,4-Dinitrophenyl)glycine

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

Dinitrophenyl-ε-aminocaproic acid10466-72-570 % similar 2-[(2,4-Dinitrophenyl)amino]ethanol1945-92-261 % similar 2,4-Dinitrophenylacetic acid643-43-661 % similar N-(2,4-Dinitrophenyl)-L-serine1655-64-755 % similar 2,4-Dinitrophenyl-L-alanine1655-52-354 % similar 4-Nitrohippuric acid2645-07-053 % similar N-(2,4-Dinitrophenyl)-L-valine1694-97-952 % similar 2,4-Dinitrobenzoic acid610-30-051 % similar

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

Elsewhere

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