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Substance Name: Amylocaine [BAN]
RN: 644-26-8
UNII: QRW683O56T
InChIKey: FDMBBCOBEAVDAO-UHFFFAOYSA-N

Molecular Formula

  • C14-H21-N-O2

Molecular Weight

  • 235.3249
 
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Names and Synonyms

Name of Substance

  • Amylocaine
  • Amylocaine [BAN]

Synonyms

  • 1-(Dimethylaminomethyl)-1-methylpropyl benzoate
  • 4-09-00-00566 (Beilstein Handbook Reference)
  • Amyleine
  • Amylocaine
  • BRN 2453568
  • EINECS 211-411-1
  • Stovaine
  • UNII-QRW683O56T

Systematic Names

  • 1-((Dimethylamino)methyl)-1-methylpropyl benzoate
  • 1-(Dimethylamino)-2-methyl-2-butanol benzoate
  • 2-Butanol, 1-(dimethylamino)-2-methyl-, benzoate (ester)

Registry Numbers

CAS Registry Number

  • 644-26-8

FDA UNII

  • QRW683O56T

Related Registry Number

  • 532-59-2 (hydrochloride)

System Generated Number

  • 0000644268

Structure Descriptors

InChI

1S/C14H21NO2/c1-5-14(2,11-15(3)4)17-13(16)12-9-7-6-8-10-12/h6-10H,5,11H2,1-4H3

InChIKey

FDMBBCOBEAVDAO-UHFFFAOYSA-N

Smiles

CCC(C)(CN(C)C)OC(=O)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo intravenous 23mg/kg (23mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
cat LDLo subcutaneous 500mg/kg (500mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Pharmacology and Experimental Therapeutics. Vol. 9, Pg. 231, 1917.
dog LDLo intraperitoneal 100mg/kg (100mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
dog LDLo subcutaneous 100mg/kg (100mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
frog LDLo intraspinal 45mg/kg (45mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 45, Pg. 291, 1932.
guinea pig LDLo intraperitoneal 180mg/kg (180mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
guinea pig LDLo intravenous 10mg/kg (10mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
guinea pig LDLo subcutaneous 210mg/kg (210mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
mouse LDLo intraperitoneal 170mg/kg (170mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
mouse LDLo subcutaneous 170mg/kg (170mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
pigeon LDLo intraperitoneal 240mg/kg (240mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
rabbit LDLo intraperitoneal 150mg/kg (150mg/kg)   "Abdernalden's Handbuch der Biologischen Arbeitsmethoden." Vol. 4, Pg. 1289, 1935.
rabbit LDLo intravenous 28mg/kg (28mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
rabbit LDLo subcutaneous 178mg/kg (178mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.
rat LDLo intravenous 25mg/kg (25mg/kg)   Physiological Reviews. Vol. 12, Pg. 190, 1932.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.890 (none)   EST
Water Solubility 992 mg/L 25 EST
Vapor Pressure 7.47E-04 mm Hg 25 EST
Henry's Law Constant 5.35E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.27E-11 cm3/molecule-sec 25 EST

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