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Home Indole and Oxindoles 85-40-5
85-40-5,MFCD00042782
Catalog No.:AA003UMB

85-40-5 | 3a,4,7,7a-Tetrahydro-1H-isoindole-1,3(2H)-dione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
95%
in stock  
$18.00   $13.00
- +
25g
95%
in stock  
$24.00   $17.00
- +
100g
95%
in stock  
$54.00   $38.00
- +
500g
95%
in stock  
$202.00   $142.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003UMB
Chemical Name:
3a,4,7,7a-Tetrahydro-1H-isoindole-1,3(2H)-dione
CAS Number:
85-40-5
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
MDL Number:
MFCD00042782
SMILES:
O=C1NC(=O)C2C1CC=CC2
NSC Number:
59011
Properties
Properties
 
BP:
336.8°C at 760 mmHg  
Form:
Solid  
MP:
132-140 °C  
Refractive Index:
1.5810 (estimate)  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
221  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Undefined Atom Stereocenter Count:
2  
XLogP3:
0.2  

Literature

Title: Toxicokinetic modeling of captan fungicide and its tetrahydrophthalimide biomarker of exposure in humans.

Journal: Toxicology letters 20120813

Title: Toxicokinetics of captan and folpet biomarkers in orally exposed volunteers.

Journal: Journal of applied toxicology : JAT 20120301

Title: Toxicokinetics of captan and folpet biomarkers in dermally exposed volunteers.

Journal: Journal of applied toxicology : JAT 20120301

Title: Air pollutants formed in thermal decomposition of folpet fungicide under oxidative conditions.

Journal: Environmental science & technology 20110115

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Tetrabutylammonium bromide media aza-Michael addition of 1,2,3,6-tetrahydrophthalimide to symmetrical fumaric esters and acrylic esters under solvent-free conditions.

Journal: Molecules (Basel, Switzerland) 20101021

Title: Antinociceptive effects of tetrahydrophthalimides and related compounds.

Journal: Zeitschrift fur Naturforschung. C, Journal of biosciences 20070101

Title: GC-ITMS determination and degradation of captan during winemaking.

Journal: Journal of agricultural and food chemistry 20031105

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SDS
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Tags:85-40-5 Molecular Formula|85-40-5 MDL|85-40-5 SMILES|85-40-5 3a,4,7,7a-Tetrahydro-1H-isoindole-1,3(2H)-dione