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Substance Name: Aspartic acid-beta-4-nitroanilide
RN: 102-66-9
InChIKey: MYMZLBHZVRWYRE-UHFFFAOYSA-N

Note

  • The sodium salt is suosan, a high potency sweetener derived from beta-alanine.

Molecular Formula

  • C10-H11-N3-O5

Molecular Weight

  • 253.213
 
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Names and Synonyms

Name of Substance

  • Aspartic acid-beta-4-nitroanilide

Synonyms

  • Aspartic acid-beta-p-nitroanilide
  • N-(4-Nitrophenyl)-N'-(carboxyethyl)urea
  • Suosan

Systematic Name

  • beta-Alanine, N-(((4-nitrophenyl)amino)carbonyl)-

Registry Numbers

CAS Registry Number

  • 102-66-9

Related Registry Number

  • 140-46-5 (hydrochloride salt)

System Generated Number

  • 0000102669

Structure Descriptors

InChI

1S/C10H11N3O5/c14-9(15)5-6-11-10(16)12-7-1-3-8(4-2-7)13(17)18/h1-4H,5-6H2,(H,14,15)(H2,11,12,16)

InChIKey

MYMZLBHZVRWYRE-UHFFFAOYSA-N

Smiles

[O-][N+](=O)c1ccc(cc1)NC(=O)NCCC(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.310 (none)   EST
Water Solubility 500 mg/L 20 EXP
Atmospheric OH Rate Constant 1.24E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.