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Carbarsone

CAT: 0013-GTR19202266-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202266-01Size:25 mg
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Description
Carbarsone is a small molecule organoarsenical historically used as an anti-amoebic agent. It serves as a research chemical for studying parasitic infections, with applications in both in vitro assays and in vivo models of intestinal amoebiasis.
CAS Number
121-59-5
Field of Research
Pharmacology & Drug Discovery
Smiles
[As] (=O) (O) (O) C1=CC=C (NC (N) =O) C=C1
Molecular Formula
C7H9AsN2O4
Molecular Weight
260.08
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Carbarsone

[4-(carbamoylamino)phenyl]arsonic acid is a member of ureas.

CAS Number121-59-5
PubChem CID8480
IUPAC Name[4-(carbamoylamino)phenyl]arsonic acid
Molecular FormulaC7H9AsN2O4
Molecular Weight260.08
Topological Polar Surface Area113
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity256
SMILES
C1=CC(=CC=C1NC(=O)N)[As](=O)(O)O
InChI
InChI=1S/C7H9AsN2O4/c9-7(11)10-6-3-1-5(2-4-6)8(12,13)14/h1-4H,(H3,9,10,11)(H2,12,13,14)
InChIKey
WWXBHTZSYYGCSG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Carbarsone
CAS: 121-59-5
CID: 8480
Formula: C7H9AsN2O4
MW: 260.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight260.08
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass259.977826
Monoisotopic Mass259.977826
Topological Polar Surface Area113 Ų
Heavy Atom Count14
Formal Charge0
Complexity256
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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