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2,3-Dihydrobenzofuran

CAT: 0013-GTR19156775-01Size: 1 gDry Ice: NoHazardous: No
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Description
2,3-Dihydrobenzofuran is an acetylcholinesterase (AChE) inhibitor isolated from leaves of L. camara. Coumaran can be used as a biopesticide. 2,3-dihydrobenzofuran is a member of the class of 1-benzofurans that is the 2,3-dihydroderivative of benzofuran. It has a role as a metabolite.The in vitro inhibition of acetylcholinesterase was increased with the concentration of Coumaran in the housefly (head and thorax) homogenate. Activity of acetylcholinesterase in insects exposed to LC25, LC50, and LC90 doses of Coumaran was markedly inhibited in dose-dependent studies in the head and thorax of housefly and homogenate of stored grain insect pests. The in vivo enzyme inhibition was dose dependent and correlated with the knockdown effect measured at 45 min of exposure in the fumigation bioassay.
CAS Number
496-16-2
Product Name Alternative
2,3-Dihydrobenzofuran
Purity
>98% (HPLC)
Solubility
In Vitro: H2O : 150 mg/mL (1248.44 mM)
Smiles
C1Cc2ccccc2O1
Molecular Formula
C8H8O
Molecular Weight
120.15
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Dihydrobenzofuran

2,3-dihydrobenzofuran is a member of the class of 1-benzofurans that is the 2,3-dihydroderivative of benzofuran. It has a role as a metabolite.

CAS Number496-16-2
PubChem CID10329
IUPAC Name2,3-dihydro-1-benzofuran
Molecular FormulaC8H8O
Molecular Weight120.15
XLogP2.1
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity101
SMILES
C1COC2=CC=CC=C21
InChI
InChI=1S/C8H8O/c1-2-4-8-7(3-1)5-6-9-8/h1-4H,5-6H2
InChIKey
HBEDSQVIWPRPAY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dihydrobenzofuran
CAS: 496-16-2
CID: 10329
Formula: C8H8O
MW: 120.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight120.15
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass120.057514874
Monoisotopic Mass120.057514874
Topological Polar Surface Area9.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity101
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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