Proflavine Hemisulfate

CAT: 0572-TRC-P014645-500MGSize: 500 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-P014645-500MGSize:500 mg

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CAS Number

1811-28-5

Synonyms

3,6-Acridinediamine sulfate (2:1) hydrate

Hazard Statement

Harmful if swallowed

Smiles

Nc1ccc2cc3ccc(N)cc3nc2c1.Nc4ccc5cc6ccc(N)cc6nc5c4.OS(=O)(=O)O

Molecular Formula

C13 H11 N3 . 0.5 H2 S O4 . x H2 O

Additionnal Information

IUPAC name: acridine-3,6-diamine;hemisulfate;hydrate

Shipping Conditions

Room Temperature

Storage Conditions

-20°C

Chemical Information

3,6-Acridinediamine, sulfate (2:1)

Proflavine Hemisulfate is the hemisulfate salt form of proflavine, an acridine-derived fluorescent contrast and disinfectant agent that can potentially be used for cellular imaging and antiseptic purposes. Upon topical application of proflavine hemisulfate, proflavine diffuses into cells and intercalates into DNA, thereby accumulating in and staining the nucleus.

CAS Number	1811-28-5
PubChem CID	9849425
IUPAC Name	bis(acridine-3,6-diamine);sulfuric acid
Molecular Formula	C26H24N6O4S
Molecular Weight	516.6
Topological Polar Surface Area	213
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	0
Heavy Atom Count	37
Formal Charge	0
Complexity	313

SMILES

C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.OS(=O)(=O)O

InChI

InChI=1S/2C13H11N3.H2O4S/c2*14-10-3-1-8-5-9-2-4-11(15)7-13(9)16-12(8)6-10;1-5(2,3)4/h2*1-7H,14-15H2;(H2,1,2,3,4)

InChIKey

YADYXCVYLIKQJX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1811-28-5

CID: 9849425

Formula: C26H24N6O4S

MW: 516.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	516.6
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	0
Exact Mass	516.15797444
Monoisotopic Mass	516.15797444
Topological Polar Surface Area	213 Å²
Heavy Atom Count	37
Formal Charge	0
Complexity	313
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
B1821-5.1	Proflavine Hemisulfate
sc-215749	Proflavine hemisulfate salt
GT1397-5g	Proflavine hemisulfate salt hydrate
C6412-50	Proflavine

Proflavine Hemisulfate

Chemical Information

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