chempirical

Hippuric acid

C9H9NO3CAS 495-69-2179.18 g/mol

Open in Covalent MOL file
OHONHO
AlcoholCarboxylic Acid

Properties

Molecular formula
C9H9NO3
Molar mass
179.18 g/mol
Exact mass
179.0582 Da
Density
1.37 g/mL
Melting point
191.5 °C
logP
1.08Crippen estimate
Polar surface area
69.9 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3

Identifiers

CAS number
495-69-2
SMILES
O=C(O)CN=C(O)c1ccccc1
InChIKey
QIAFMBKCNZACKA-UHFFFAOYSA-N
InChI
InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)

Weigh it out

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

Names and synonyms

12 names
  • N-Benzoylglycine
  • Benzoylglycine
  • Acetic acid, (benzoylamino)-
  • Benzamidoacetic acid
  • Phenylcarbonylaminoacetic acid
  • Glycine, N-benzoyl-
  • 2-Benzamidoacetic acid
  • NSC 9982
  • 2-(Benzoylamino)acetic acid
  • Benzoyl glycocoll
  • N-(Phenylcarbonyl)glycine
  • 2-(Phenylformamido)acetic acid

Work with Hippuric 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

N-1,3-Benzodioxol-5-ylacetamide13067-19-1 3-(4-Nitrophenyl)-2-propen-1-ol1504-63-8 1-(3-Nitrophenyl)-1-propanone17408-16-1 3A,4,7,7A-Tetrahydro-2-hydroxy-4,7-methano-1H-isoindole-1,3(2H)-dione21715-90-2 1-(6-Amino-1,3-benzodioxol-5-yl)ethanone28657-75-2 1-Methoxy-4-(2-nitroethenyl)benzene3179-10-0 2-Methoxy-β-nitrostyrene3316-24-3 5-Acetyl-2-hydroxybenzamide40187-51-7

Elsewhere

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