chempirical

2-(4-Nitrophenyl)propionic acid

C9H9NO4CAS 19910-33-9195.17 g/mol

Open in Covalent MOL file
OHON+OO−
AlcoholCarboxylic AcidNitroTertiary Amine

Properties

Molecular formula
C9H9NO4
Molar mass
195.17 g/mol
Exact mass
195.0532 Da
Melting point
100–100.5 °C
logP
1.78Crippen estimate
Polar surface area
80.4 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Identifiers

CAS number
19910-33-9
SMILES
CC(C(=O)O)c1ccc([N+](=O)[O-])cc1
InChIKey
RBSRRICSXWXMRC-UHFFFAOYSA-N
InChI
InChI=1S/C9H9NO4/c1-6(9(11)12)7-2-4-8(5-3-7)10(13)14/h2-6H,1H3,(H,11,12)

Weigh it out

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

Names and synonyms

6 names
  • Benzeneacetic acid, α-methyl-4-nitro-
  • Hydratropic acid, p-nitro-
  • α-Methyl-4-nitrobenzeneacetic acid
  • 2-(p-Nitrophenyl)propionic acid
  • 2-(4-Nitrophenyl)propanoic acid
  • (±)-2-(4-Nitrophenyl)propionic acid

Work with 2-(4-Nitrophenyl)propionic acid

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

Same formula

5-Ethyl-2,3-pyridinedicarboxylic acid102268-15-5 4-Ethyl-3-nitrobenzoic acid103440-95-5 2-Hydroxyhippuric acid16555-77-4 3-(4-Nitrophenyl)propionic acid16642-79-8 2-Methyl-3-nitrobenzeneacetic acid23876-15-5 Methyl 3-methyl-4-nitrobenzoate24078-21-5 Salicylamide O-acetic acid25395-22-6 1-Methyl 5-amino-1,3-benzenedicarboxylate28179-47-7

Elsewhere

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