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Substance Name: 1H-Isoindole-1,3(2H)-dione, 2-(1-methylpropyl)-
RN: 10108-61-9
InChIKey: ZTXOTHWCDVUQRM-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Insect Attractant, Repellent and Chemosterilant

Molecular Formula

  • C12-H13-N-O2

Molecular Weight

  • 203.24
 
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Names and Synonyms

Synonyms

  • AI3-02419
  • EINECS 233-295-1
  • N-sec-Butylphthalimide
  • N-sek.Butylftalimid
  • N-sek.Butylftalimid [Czech]
  • NSC 5681

Systematic Names

  • 1H-Isoindole-1,3(2H)-dione, 2-(1-methylpropyl)-
  • N-sec-Butylphthalimide
  • Phthalimide, N-sec-butyl-

Registry Numbers

CAS Registry Number

  • 10108-61-9

Other Registry Number

  • 35648-75-0

System Generated Number

  • 0010108619

Structure Descriptors

InChI

1S/C12H13NO2/c1-3-8(2)13-11(14)9-6-4-5-7-10(9)12(13)15/h4-8H,3H2,1-2H3

InChIKey

ZTXOTHWCDVUQRM-UHFFFAOYSA-N

Smiles

N1(C(c2ccccc2C1=O)=O)[C@@H](CC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 1200uL/kg (1.2mL/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, ALLERGIC: AFTER SYSTEMIC EXPOSURE" Journal of Pharmacology and Experimental Therapeutics. Vol. 93, Pg. 26, 1948.
guinea pig LD50 skin > 10mL/kg (10mL/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 93, Pg. 26, 1948.
mouse LD50 oral 1600uL/kg (1.6mL/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, ALLERGIC: AFTER SYSTEMIC EXPOSURE" Journal of Pharmacology and Experimental Therapeutics. Vol. 93, Pg. 26, 1948.
rabbit LD50 oral 2300uL/kg (2.3mL/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, ALLERGIC: AFTER SYSTEMIC EXPOSURE" Journal of Pharmacology and Experimental Therapeutics. Vol. 93, Pg. 26, 1948.
rat LD50 oral 1100uL/kg (1.1mL/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 93, Pg. 26, 1948.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.910 (none)   EST
Water Solubility 250 mg/L 35 EXP
Atmospheric OH Rate Constant 2.70E-11 cm3/molecule-sec 25 EST

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