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Decarbofuran

CAT: 0013-GTR19197795-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19197795-01Size:25 mg
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Description
Decarbofuran is a carbamate insecticide used in research to study acetylcholinesterase inhibition. It is applied in both in vitro enzyme assays and in vivo toxicological studies within environmental and agricultural science research.
CAS Number
1563-67-3
Smiles
O=C (OC1=CC=CC2=C1OC (C) C2) NC
Molecular Formula
C11H13NO3
Molecular Weight
207.23
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Decarbofuran

Decarbofuran is a carbamate pesticide. Carbamate pesticides are derived from carbamic acid and kill insects in a similar fashion as organophosphate insecticides. They are widely used in homes, gardens and agriculture. The first carbamate, carbaryl, was introduced in 1956 and more of it has been used throughout the world than all other carbamates combined. Because of carbaryl's relatively low mammalian oral and dermal toxicity and broad control spectrum, it has had wide use in lawn and garden settings. Most of the carbamates are extremely toxic to Hymenoptera, and precautions must be taken to avoid exposure to foraging bees or parasitic wasps. Some of the carbamates are translocated within plants, making them an effective systemic treatment. (L795)

CAS Number1563-67-3
PubChem CID15279
IUPAC Name(2-methyl-2,3-dihydro-1-benzofuran-7-yl) N-methylcarbamate
Molecular FormulaC11H13NO3
Molecular Weight207.23
XLogP2.1
Topological Polar Surface Area47.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity244
SMILES
CC1CC2=C(O1)C(=CC=C2)OC(=O)NC
InChI
InChI=1S/C11H13NO3/c1-7-6-8-4-3-5-9(10(8)14-7)15-11(13)12-2/h3-5,7H,6H2,1-2H3,(H,12,13)
InChIKey
JTBBRGSSVACAJM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Decarbofuran
CAS: 1563-67-3
CID: 15279
Formula: C11H13NO3
MW: 207.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight207.23
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass207.08954328
Monoisotopic Mass207.08954328
Topological Polar Surface Area47.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity244
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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