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Substance Name: Ammonium benzoate [USP]
RN: 1863-63-4
UNII: AC80WD7GPF
InChIKey: VWSRWGFGAAKTQG-UHFFFAOYSA-N

Classification Code

  • Reportable Quantity (RQ) = 5000 lb

Molecular Formula

  • C7-H6-O2.H3-N

Molecular Weight

  • 139.153
 
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Names and Synonyms

Name of Substance

  • Ammonium benzoate
  • Ammonium benzoate [USP]

Synonyms

  • AI3-07834
  • Ammonii benzoas
  • Ammonium benzoate
  • Ammonium benzoicum
  • Benzoic acid, ammonium salt
  • EINECS 217-468-9
  • HSDB 555
  • NSC 7918
  • UNII-AC80WD7GPF
  • Vulnoc AB

Systematic Names

  • Ammonium benzoate
  • Benzoic acid, ammonium salt
  • Benzoic acid, ammonium salt (1:1)

Superlist Names

  • Ammonium benzoate
  • Benzoic acid, ammonium salt

Registry Numbers

CAS Registry Number

  • 1863-63-4

FDA UNII

  • AC80WD7GPF

Other Registry Number

  • 14374-89-1

System Generated Number

  • 0001863634

Molecular Formulas

Molecular Formula

  • C7-H6-O2.H3-N

Molecular Formula Fragments

  • C7-H6-O2
  • COMPONENT
  • H3-N

Structure Descriptors

InChI

InChI=1S/C7H6O2.H3N/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);1H3

InChIKey

VWSRWGFGAAKTQG-UHFFFAOYSA-N

Smiles

[NH4+].[O-]C(=O)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 235mg/kg (235mg/kg) PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(1), Pg. 75, 1986.
rabbit LDLo intravenous 400mg/kg (400mg/kg) BEHAVIORAL: EXCITEMENT Journal of Pharmacology and Experimental Therapeutics. Vol. 44, Pg. 81, 1932.
rat LD50 oral 825mg/kg (825mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE
Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 51(1), Pg. 75, 1986.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 194.5 deg C   EXP
log P (octanol-water) -1.330 (none)   EST
Atmospheric OH Rate Constant 1.78E-12 cm3/molecule-sec 25 EST

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