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2-Benzylisothiourea hydrochloride

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Identification
Molecular formula
C9H12ClN3S
CAS number
52105-89-0
IUPAC name
2-benzylisothiourea;hydrochloride
State
State

At room temperature, 2-Benzylisothiourea hydrochloride is a solid compound. It is typically stable under recommended storage conditions.

Melting point (Celsius)
141.00
Melting point (Kelvin)
414.20
Boiling point (Celsius)
304.40
Boiling point (Kelvin)
577.50
General information
Molecular weight
216.72g/mol
Molar mass
216.7100g/mol
Density
1.1980g/cm3
Appearence

2-Benzylisothiourea hydrochloride typically appears as a white to off-white crystalline powder. It is often utilized in research and industrial applications due to its reactive isothiourea group.

Comment on solubility

Solubility of 2-benzylisothiourea hydrochloride

The solubility of 2-benzylisothiourea hydrochloride in various solvents is influenced by its chemical structure and the presence of the hydrochloride moiety. Typically, this compound is soluble in polar solvents, which can effectively stabilize the ionized form of the hydrochloride. Here are some key points to consider:

  • Water: 2-benzylisothiourea hydrochloride is generally soluble in water due to its ionic nature, allowing it to dissociate and interact favorably.
  • Organic Solvents: The compound may show variable solubility in organic solvents. Polar protic solvents like methanol or ethanol can also dissolve it effectively.
  • Temperature Dependence: Solubility can increase with temperature; thus, dissolving it in hot water may yield better results.
  • Impact of pH: The solubility is also affected by the pH of the solution, where a more acidic environment generally enhances solubility because it keeps the compound in its ionized form.

In summary, one might say that "solubility is a dance of molecular interactions and environmental factors," and understanding these interactions is crucial for the practical applications of 2-benzylisothiourea hydrochloride in various fields.

Interesting facts

Interesting Facts about 2-Benzylisothiourea Hydrochloride

2-Benzylisothiourea hydrochloride is a fascinating compound that has captured the interest of scientists due to its unique properties and applications. Here are some key points to consider:

  • Biological Activity: This compound is known for its potential as a biochemical inhibitor. It interferes with various biochemical pathways, which makes it a valuable subject of study in pharmacology and biochemistry.
  • Research Applications: 2-Benzylisothiourea hydrochloride has been utilized in research related to cancer treatment and other therapeutic areas. Its mechanism of action often involves the inhibition of specific enzymes, making it a focus in drug development.
  • Synthesis: The synthesis of this compound is a topic of interest in organic chemistry. It serves as a good example for students learning about nitrogen-containing compounds and how they can be modified to create derivatives with unique properties.
  • Metabolic Studies: Researchers have found that this compound can play a role in studies concerning metabolism and the behavior of cellular processes, highlighting its importance in understanding how substances interact at the molecular level.

As you explore the world of chemical compounds, remember that the study of 2-benzylisothiourea hydrochloride not only deepens our understanding of chemistry but also opens up new avenues for medical and scientific breakthroughs. The potential applications of this compound in therapeutics and biochemical research continue to intrigue and inspire researchers around the globe.

Synonyms
538-28-3
S-Benzylthiuronium chloride
Benzylisothiuronium chloride
S-Benzylthiouronium chloride
Benzylisothiouronium chloride
Benzylthiuronium chloride
Benzylisothiourea hydrochloride
S-Benzylthiopseudourea hydrochloride
S-Benzylthioformamidine hydrochloride
2-Benzylisothiouronium chloride
USAF EK-2124
Carbamimidothioic acid, phenylmethyl ester, monohydrochloride
Isothiouronium chloride, benzyl-
Benzyl thiopseudourea hydrochloride
S-benzylthiourea hydrochloride
TL 944
A-287
X 182
EINECS 208-688-6
Pseudourea, 2-benzyl-2-thio-, hydrochloride
NSC 179799
AI3-17804
Pseudourea, 2-thio-2-benzyl-, hydrochloride
S-BENZYLISOTHIURONIUM CHLORIDE
Pseudourea, 2-benzyl-2-thio-, monohydrochloride
S-BENZYLISOTHIOURONIUM CHLORIDE
NSC-179799
Carbamidothioic acid, phenylmethyl ester, monohydrochloride
Carbamimidothioic acid, phenylmethyl ester, hydrochloride (1:1)
S-BENZYLTHIOUREA HYDROCHLORIDE [MI]
DTXSID0060222
SBenzylthiouronium chloride
2Benzylisothiouronium chloride
Isothiouronium chloride, benzyl
SBenzylisothiourea hydrochloride
DTXCID1041506
SBenzylthiopseudourea hydrochloride
SBenzylthioformamidine hydrochloride
Pseudourea, 2benzyl2thio, hydrochloride
Pseudourea, 2thio2benzyl, hydrochloride
Pseudourea, 2benzyl2thio, monohydrochloride
208-688-6
S-Benzylisothiourea hydrochloride
2-Benzyl-2-thiopseudourea hydrochloride
benzyl carbamimidothioate hydrochloride
BTKH
benzyl carbamimidothioate;hydrochloride
QJ9N8049ND
CHEMBL1224309
WLN: MUYZS1R &GH
(benzylsulfanyl)methanimidamide hydrochloride
UNII-QJ9N8049ND
2-Benzylisothiourea
MFCD00012583
S-Benzylisothiourea HCl
BENZYL IMIDOTHIOCARBAMATE HYDROCHLORIDE
Benzyl carbamimidothioate HCl
SCHEMBL893859
NSC3206
NSC8057
benzylcarbamimidothioatehydrochloride
NSC-3206
NSC-8057
NSC179799
STL098063
S-Benzyl-isothioharnstoff-hydrochlorid
AKOS004912470
AB01105
CS-W015488
FB71164
SB78173
2-benzyl-2-thiopseudo-urea hydrochloride
2-Benzyl-2-thiopseudourea, hydrochloride
PD207412
DB-052405
DB-266727
B0442
2-Benzyl-2-thiopseudourea hydrochloride, 98%
EN300-78137
D88650
Q27287293
Z89242849
Carbamimidothioic acid phenylmethyl ester monohydrochloride
S-Benzylisothiourea hydrochloride, purum, >=98.0% (AT)