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Diphenylamine Hydrochloride

CAT: 0013-GTR19166108-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19166108-01Size:1 g
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Description
Diphenylamine hydrochloride is a natural antioxidant isolated from coriander. It serves as a fungicidal and antibacterial agent in agricultural research and as an antioxidant and dye mordant in industrial applications, with utility in both in vitro and in vivo experimental models.
CAS Number
537-67-7
Product Name Alternative
Inhibitor, inhibit, N-Phenylaniline, Diphenylamine, Diphenylamine Hydrochloride
Field of Research
Infectious Disease & Virology
Purity
98.00% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (9.72 mM) ; DMSO:50 mg/mL (243.1 mM)
Smiles
Cl.N (c1ccccc1) c1ccccc1
Molecular Formula
C12H12ClN
Molecular Weight
205.68
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Diphenylamine hydrochloride
CAS Number537-67-7
PubChem CID68311
IUPAC NameN-phenylaniline;hydrochloride
Molecular FormulaC12H12ClN
Molecular Weight205.68
Topological Polar Surface Area12
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity116
SMILES
C1=CC=C(C=C1)NC2=CC=CC=C2.Cl
InChI
InChI=1S/C12H11N.ClH/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-10,13H;1H
InChIKey
JEFJSEIUEJBMSR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diphenylamine hydrochloride
CAS: 537-67-7
CID: 68311
Formula: C12H12ClN
MW: 205.68
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight205.68
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass205.0658271
Monoisotopic Mass205.0658271
Topological Polar Surface Area12 Ų
Heavy Atom Count14
Formal Charge0
Complexity116
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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