5-Amino-3H-1,2,4-dithiazole-3-thione

Name: 5-Amino-3H-1,2,4-dithiazole-3-thione
Brand: BOC Sciences
Price: 299 USD
Availability: MadeToOrder

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Molecular Formula:

C2H2N2S3

Molecular Weight:

150.25

CAS Number:

6846-35-1

Catalog Number:

BPM-075180

Catalog Number	Size	Price	Stock	Quantity
BPM-075180	100 g	$299	In stock
BPM-075180	500 g	$629	In stock

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Product Information

Molecular Formula

C2H2N2S3

Molecular Weight

150.25

Description

5-Amino-3H-1,2,4-dithiazole-3-thione, a chemical heterocycle with molecular formula C3H2N4S2, has emerged as a promising precursor for drug synthesis and organic compound fabrication. This unique compound exhibits a plethora of potential therapeutic effects, manifesting as a versatile agent for cancer-treatment and antimicrobial interventions against bacterial and fungal invasions in humans. Its pharmacological versatility derives from the compound's intricate structure, allowing for diverse chemical interactions and reactivity.

Synonyms

3-Amino-1,2,4-dithiazole-5-thione; Xanthane hydride; 5-Amino-3H-1,2,4-dithiazole-3-thione

IUPAC Name

5-amino-1,2,4-dithiazole-3-thione

Canonical SMILES

C1(=NC(=S)SS1)N

InChI

InChI=1S/C2H2N2S3/c3-1-4-2(5)7-6-1/h(H2,3,4,5)

InChI Key

YWZHEXZIISFIDA-UHFFFAOYSA-N

Boiling Point

282.0±23.0 °C at 760 mmHg

Melting Point

201-203°C

Purity

95%

Density

2.0±0.1 g/cm3

Appearance

Light yellow to Brown powder to crystal

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

QC Data

HPLC

HNMR

Computed Properties

XLogP3

0.6

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

149.93801159 g/mol

Monoisotopic Mass

149.93801159 g/mol

Topological Polar Surface Area

121Å²

Heavy Atom Count

Formal Charge

Complexity

129

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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