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Substance Name: Benzamide, N-(4-aminobutyl)-
RN: 5692-23-9
InChIKey: VMQHGBUSMBFWHN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N2-O

Molecular Weight

  • 192.26
 
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Names and Synonyms

Synonyms

  • 4-09-00-00862 (Beilstein Handbook Reference)
  • Benzoylputrescine
  • BRN 2094940
  • N-(4-Aminobutyl)benzamide

Systematic Name

  • Benzamide, N-(4-aminobutyl)-

Registry Numbers

CAS Registry Number

  • 5692-23-9

System Generated Number

  • 0005692239

Structure Descriptors

InChI

1S/C11H16N2O/c12-8-4-5-9-13-11(14)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,12H2,(H,13,14)

InChIKey

VMQHGBUSMBFWHN-UHFFFAOYSA-N

Smiles

c1ccccc1C(=O)NCCCCN

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 840mg/kg (840mg/kg) VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Farmakologiya i Toksikologiya Vol. 18(6), Pg. 9, 1955.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.58 (none)   EXP
Water Solubility 1.53E+04 mg/L 25 EST
Vapor Pressure 3.14E-06 mm Hg 25 EST
Henry's Law Constant 1.17E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.65E-11 cm3/molecule-sec 25 EST

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