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4-Aminophenylarsonic acid

CAT: 1410-M19528Size: 1 EachDry Ice: NoHazardous: No
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Description
4-Aminophenylarsonic acid (Arsanilic Acid) is an organoarsenic compound with activity as an anti-infective agent.
CAS Number
98-50-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
217.06
Molecular Formula
C6H8AsNO3
Notes
Research use only, not for human use.
Receptor
Lysozyme C

Chemical Information

Arsanilic Acid

Arsanilic acid is an organoarsonic acid. It is a conjugate acid of an arsanilate(1-).

CAS Number98-50-0
PubChem CID7389
IUPAC Name(4-aminophenyl)arsonic acid
Molecular FormulaC6H8AsNO3
Molecular Weight217.05
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity171
SMILES
C1=CC(=CC=C1N)[As](=O)(O)O
InChI
InChI=1S/C6H8AsNO3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H,8H2,(H2,9,10,11)
InChIKey
XKNKHVGWJDPIRJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Arsanilic Acid
CAS: 98-50-0
CID: 7389
Formula: C6H8AsNO3
MW: 217.05
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight217.05
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass216.972013
Monoisotopic Mass216.972013
Topological Polar Surface Area83.6 Ų
Heavy Atom Count11
Formal Charge0
Complexity171
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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