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Substance Name: 4-Aminopropiophenone
RN: 70-69-9
UNII: 79GF917W6U
InChIKey: FSWXOANXOQPCFF-UHFFFAOYSA-N

Molecular Formula

  • C9-H11-N-O

Molecular Weight

  • 149.192
 

Classification Codes

Classification Codes

  • Drug / Therapeutic Agent
  • Protective Agents
  • Radiation-Protective Agents

Superlist Classification Code

  • Threshold Planning Quantity (TPQ) = 100/10000 lb
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Names and Synonyms

Name of Substance

  • 4-Aminopropiophenone

Synonyms

  • 1-(4-Aminophenyl)-1-propanone
  • 4'-Aminopropiophenone
  • 4-14-00-00139 (Beilstein Handbook Reference)
  • AI3-14675
  • BRN 2802691
  • EINECS 200-742-7
  • Ethyl p-aminophenyl ketone
  • HSDB 7963
  • NSC 3187
  • p-Aminopropiophenone
  • PAPP
  • Paraminopropiophenone
  • UNII-79GF917W6U
  • USAF uctl-1856

Systematic Names

  • 1-Propanone, 1-(4-aminophenyl)-
  • 4'-Aminopropiophenone
  • Propiophenone, 4'-amino-

Superlist Names

  • 4'-Aminopropiophenone
  • Propiophenone, 4'-amino-
  • Propiophenone, 4-amino-

Registry Numbers

CAS Registry Number

  • 70-69-9

FDA UNII

  • 79GF917W6U

Related Registry Number

  • 6170-25-8 (hydrochloride)

System Generated Number

  • 0000070699

Structure Descriptors

InChI

1S/C9H11NO/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3

InChIKey

FSWXOANXOQPCFF-UHFFFAOYSA-N

Smiles

c1(ccc(N)cc1)C(CC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - wild LD50 oral 133mg/kg (133mg/kg)   Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.
cat LD50 oral 5600ug/kg (5.6mg/kg) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS Bulletin of Environmental Contamination and Toxicology. Vol. 30, Pg. 122, 1983.
dog LD50 intravenous 7150ug/kg (7.15mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 89, Pg. 109, 1947.
dog LD50 oral 50mg/kg (50mg/kg) BLOOD: METHEMOGLOBINEMIA-CARBOXYHEMOGLOBIN Journal of Pharmacology and Experimental Therapeutics. Vol. 80, Pg. 31, 1944.
dog LD50 unreported 7500ug/kg (7.5mg/kg)   Canadian Journal of Biochemistry and Physiology. Vol. 38, Pg. 667, 1960.
guinea pig LD50 oral 1020mg/kg (1020mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

SKIN AND APPENDAGES (SKIN): HAIR: OTHER

LUNGS, THORAX, OR RESPIRATION: CYANOSIS
Toxicology Letters. Vol. 23, Pg. 359, 1984.
mammal (species unspecified) LD50 oral 5600ug/kg (5.6mg/kg)   Bulletin of Environmental Contamination and Toxicology. Vol. 30, Pg. 122, 1983.
mouse LD50 intraperitoneal 80mg/kg (80mg/kg)   National Technical Information Service. Vol. AD277-689,
mouse LD50 intravenous 145mg/kg (145mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

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

LUNGS, THORAX, OR RESPIRATION: CYANOSIS
Toxicology Letters. Vol. 23, Pg. 359, 1984.
mouse LD50 oral 168mg/kg (168mg/kg)   General Pharmacology. Vol. 14, Pg. 465, 1983.
quail LD50 oral > 316mg/kg (316mg/kg)   Ecotoxicology and Environmental Safety. Vol. 6, Pg. 149, 1982.
rabbit LD50 intramuscular 9600ug/kg (9.6mg/kg)   Zhongguo Yaoli Xuebao. Acta Pharmacologica Sinica. Chinese Journal of Pharmacology. Vol. 9, Pg. 178, 1988.
rat LD50 intraperitoneal 55mg/kg (55mg/kg) BLOOD: METHEMOGLOBINEMIA-CARBOXYHEMOGLOBIN Journal of Pharmacology and Experimental Therapeutics. Vol. 80, Pg. 31, 1944.
rat LD50 oral 177mg/kg (177mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING Bulletin of Environmental Contamination and Toxicology. Vol. 30, Pg. 122, 1983.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 140 deg C   EXP
log P (octanol-water) 1.250 (none)   EST
Water Solubility 352 mg/L 37 EXP
Atmospheric OH Rate Constant 9.94E-11 cm3/molecule-sec 25 EST

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