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Sodium 4-Aminophenylarsonate

CAT: 0024-sc-472378Size: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-472378Size:25 g
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CAS Number
127-85-5

Chemical Information

Sodium Arsanilate

Sodium arsanilate is an organic sodium salt and an organoarsonic acid salt. It has a role as an antisyphilitic drug. It contains an arsanilate(1-).

CAS Number127-85-5
PubChem CID23670523
IUPAC Namesodium (4-aminophenyl)-hydroxyarsinate
Molecular FormulaC6H7AsNNaO3
Molecular Weight239.04
Topological Polar Surface Area86.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity182
SMILES
C1=CC(=CC=C1N)[As](=O)(O)[O-].[Na+]
InChI
InChI=1S/C6H8AsNO3.Na/c8-6-3-1-5(2-4-6)7(9,10)11;/h1-4H,8H2,(H2,9,10,11);/q;+1/p-1
InChIKey
OUFRIWNNMFWZTM-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium Arsanilate
CAS: 127-85-5
CID: 23670523
Formula: C6H7AsNNaO3
MW: 239.04
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight239.04
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass238.953957
Monoisotopic Mass238.953957
Topological Polar Surface Area86.4 Ų
Heavy Atom Count12
Formal Charge0
Complexity182
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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sc-264314ASodium 4-fluorobenzoate
sc-487220Sodium 4-Hydroxybenzenesulfonate
sc-251002Sodium 4-hydroxybenzoate
sc-460779Sodium 4-Acetylbenzenesulfonate
sc-487900Sodium 4-Nitrophenylacetate
sc-264314Sodium 4-fluorobenzoate

Alternative Products

CatalogName
OR1079358Sodium 4-Aminophenylarsonate
B1643-5000Sodium 4-Aminosalicylate
A3829-100sodium 4-pentynoate
HY-177663SARSi-4 (sodium)
FS70459-01Sodium 4-chlorobenzoate
AAA51574-01Sodium 4-aminobenzenesulfonate
HY-W004048-01Sodium 4-methylbenzenesulfonate
TRC-S622000-1GSodium 4-Decylbenzenesulfonate
T203197-014-Hydroxypentanoate sodium
T74838-01MTHFD2-IN-4 sodium

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