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2-Benzylisothiourea

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Identification
Molecular formula
C8H10N2S
CAS number
15989-32-5
IUPAC name
2-benzylisothiourea
State
State

At room temperature, 2-benzylisothiourea is commonly found in a solid state. This crystalline compound maintains its stability under standard laboratory conditions when stored suitably.

Melting point (Celsius)
120.00
Melting point (Kelvin)
393.15
Boiling point (Celsius)
250.00
Boiling point (Kelvin)
523.15
General information
Molecular weight
179.25g/mol
Molar mass
179.2490g/mol
Density
1.2450g/cm3
Appearence

2-Benzylisothiourea typically appears as a white to light yellow crystalline solid. It may also appear as a powder depending on the method of preparation. The compound is known for its slight solubility in water and is more soluble in organic solvents.

Comment on solubility

Solubility of 2-benzylisothiourea

2-benzylisothiourea, with the chemical formula C8H10N2S, presents interesting solubility characteristics that are noteworthy. Understanding the solubility can aid in various applications, particularly those involving biochemical interactions and pharmaceutical formulations.

Generally, the solubility of 2-benzylisothiourea can be summarized as follows:

  • Polar Solvents: This compound tends to be more soluble in polar solvents such as water and methanol due to its polar functional groups.
  • Non-Polar Solvents: It has limited solubility in non-polar solvents, which may restrict its utility in certain chemical environments.
  • Temperature Dependence: Like many organic compounds, its solubility may increase with temperature, making warm solvent systems more effective for dissolution.

As noted in various studies, it is crucial to observe that the solubility of 2-benzylisothiourea can be influenced by pH and the presence of other solutes, leading to complex interactions. “The solubility and stability of chemical compounds are pivotal in determining their effectiveness in applications,” stands true for this compound as well.

In conclusion, the solubility of 2-benzylisothiourea is a vital consideration for researchers and practitioners in fields that explore its use. Its behavior in different solvents requires attention to detail to optimize application outcomes.

Interesting facts

Exploring 2-Benzylisothiourea

2-Benzylisothiourea is a fascinating chemical compound in the realm of organic chemistry, renowned for its diverse applications and intriguing properties. This compound is categorized as a thiourea derivative, which means it contains a sulfur atom bonded to a carbon and nitrogen. Below are some interesting facts that highlight its significance:

  • Pharmaceutical Potential: The compound exhibits noteworthy pharmacological properties, making it valuable in drug development. Studies have shown that 2-benzylisothiourea can interact with various biological pathways, providing insights for treating certain diseases.
  • Enzyme Inhibition: This compound is known as a potent inhibitor of certain enzymes. It is often studied for its capability to obstruct the activity of nitric oxide synthase, which plays a crucial role in various physiological processes.
  • Research Tool: In the laboratory, 2-benzylisothiourea serves as an essential tool in biochemical research. Its ability to modify sulfur-containing compounds is particularly useful in synthetic organic chemistry.
  • Structure-Activity Relationship: Researchers frequently investigate the structure-activity relationship (SAR) of thioureas like 2-benzylisothiourea. This helps scientists understand how structural changes affect the compound's biological efficacy.
  • Role in Agriculture: Beyond pharmacology, 2-benzylisothiourea has attracted attention in agricultural science, where it's being studied for its potential use as a pesticide or herbicide.

Overall, 2-benzylisothiourea is not just a mere compound; it is a gateway to numerous scientific inquiries and applications. The synergy of its structural characteristics and biological activities makes it a rich subject for ongoing research and exploration in the chemical sciences.

Synonyms
S-Benzylthiourea
Benzylisothiourea
benzyl carbamimidothioate
s-benzylisothiourea
621-85-2
2-Benzyl-2-thiopseudourea
Benzylthiopseudourea
Carbamimidothioic acid, phenylmethyl ester
2-Benzyl-isothiourea
Pseudourea, 2-benzyl-2-thio-
CHEMBL505665
N844GJ98J2
NSC-229296
Benzyl imidothiocarbamate
4-06-00-02681 (Beilstein Handbook Reference)
BRN 0742882
UNII-N844GJ98J2
Carbamimidothioic acid phenylmethyl ester
Isothiourea, 2-benzyl-
Bionet2_000678
Benzyl imidothiocarbamate #
Carbamimidothioic acid, phenylmethyl ester (9CI)
(benzylsulfanyl)methanimidamide
S-BENZYLTHIOUREA [MI]
SCHEMBL974745
GTRLQRHWPXEBLF-UHFFFAOYSA-
DTXSID10211160
ALBB-019676
BDBM50271830
NSC229296
STK069652
AKOS000276264
NSC 229296
EN300-26079
AC-907/25004812
AE-641/00558057
Q27284692
CARBAMIMIDOTHIOIC ACID, PHENYLMETHYL ESTER, HYDROCHLORIDE
InChI=1/C8H10N2S/c9-8(10)11-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10)