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Carbofuran

CAT: 0024-sc-207404Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-207404Size:250 mg
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CAS Number
1563-66-2

Chemical Information

Carbofuran

Carbofuran is a carbamate ester and a member of 1-benzofurans. It has a role as an acaricide, a nematicide, an agrochemical, an avicide, an EC 3.1.1.8 (cholinesterase) inhibitor, a carbamate insecticide and an EC 3.1.1.7 (acetylcholinesterase) inhibitor.

CAS Number1563-66-2
PubChem CID2566
IUPAC Name(2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate
Molecular FormulaC12H15NO3
Molecular Weight221.25
XLogP2.3
Topological Polar Surface Area47.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity277
SMILES
CC1(CC2=C(O1)C(=CC=C2)OC(=O)NC)C
InChI
InChI=1S/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)
InChIKey
DUEPRVBVGDRKAG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Carbofuran
CAS: 1563-66-2
CID: 2566
Formula: C12H15NO3
MW: 221.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight221.25
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass221.10519334
Monoisotopic Mass221.10519334
Topological Polar Surface Area47.6 Ų
Heavy Atom Count16
Formal Charge0
Complexity277
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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