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4-Chlorophenyl isocyanate

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Identification
Molecular formula
C7H4ClNO
CAS number
104-12-1
IUPAC name
1-chloro-4-isocyanato-benzene
State
State

At room temperature, 4-Chlorophenyl isocyanate is usually in a liquid state.

Melting point (Celsius)
11.00
Melting point (Kelvin)
284.15
Boiling point (Celsius)
205.00
Boiling point (Kelvin)
478.15
General information
Molecular weight
153.57g/mol
Molar mass
153.5670g/mol
Density
1.2747g/cm3
Appearence

4-Chlorophenyl isocyanate is typically a colorless to pale yellow liquid. It is often found in a clear state without any suspended particles or sediments.

Comment on solubility

Solubility of 1-Chloro-4-isocyanato-benzene

1-Chloro-4-isocyanato-benzene, a compound with the formula C7H4ClN2O, exhibits moderate solubility characteristics that are influenced by its molecular structure. Understanding the solubility of this compound is essential for its application in various chemical processes.

Factors Influencing Solubility:

  • Polarity: The presence of both a chloro group and an isocyanate functional group provides interesting polarity dynamics. As a result, its solubility in polar solvents can be observed.
  • Hydrogen Bonding: The isocyanate group can participate in hydrogen bonding, which may enhance solubility particularly in polar solvents.
  • Size and Shape: The planar structure of the benzene ring impacts how 1-chloro-4-isocyanato-benzene interacts with different solvents.

In general, 1-chloro-4-isocyanato-benzene is expected to be soluble in organic solvents such as:

  • Acetone
  • Chloroform
  • Dichloromethane

However, it displays limited solubility in non-polar solvents due to its polar regions. As a rule of thumb, compounds tend to be more soluble in solvents that share similar polarity. Thus, for best results in cultural or laboratory applications, it is advisable to use solvents that can adequately solvate both the chloro and isocyanate functional groups.

In summary, while 1-chloro-4-isocyanato-benzene demonstrates moderate solubility, its behavior in various media is dictated by its functional groups and the nature of the solvent used, making it a compound of interest for solubility studies.

Interesting facts

Interesting Facts about 1-chloro-4-isocyanato-benzene

1-chloro-4-isocyanato-benzene, also known as p-chloro isocyanatobenzene, is a unique organic compound that has garnered attention in various fields of chemistry and materials science. Here are some captivating insights:

  • Functional Groups: This compound features both isocyanate and chloro functional groups, which impart it with interesting reactivity. The isocyanate group is known for its ability to react with nucleophiles, making it valuable in synthetic chemistry.
  • Application in Synthesis: 1-chloro-4-isocyanato-benzene is often used as an intermediate in the synthesis of various organic compounds, including polyurethanes and other polymeric materials.
  • Biological Aspects: Its derivatives have shown potential in medicinal chemistry. Some studies suggest that isocyanates can exhibit antimicrobial properties, highlighting a possible avenue for developing new pharmaceuticals.
  • Environmental Considerations: Like many isocyanates, it is essential to handle this compound with caution. Proper safety measures should always be employed, as isocyanates can be toxic, particularly upon inhalation or skin exposure.

In conclusion, the versatility and reactivity of 1-chloro-4-isocyanato-benzene make it a compound of interest in both academic and industrial chemistry. Its unique properties encourage ongoing research and application development, highlighting the dynamic nature of chemical compounds.

Synonyms
4-Chlorophenyl isocyanate
104-12-1
1-Chloro-4-isocyanatobenzene
p-Chlorophenyl isocyanate
Benzene, 1-chloro-4-isocyanato-
4-Chloroisocyanatobenzene
PCPI
para-Chlorophenyl isocyanate
4-Chlorophenylisocyanate
p-Chlorfenylisokyanat
ISOCYANIC ACID, P-CHLOROPHENYL ESTER
p-Chlorfenylisokyanat [Czech]
NSC 76589
1-chloro-4-isocyanato-benzene
HSDB 1331
EINECS 203-176-9
W46XL60WI8
DTXSID7040732
NSC-76589
DTXCID5020732
EC 203-176-9
P-CHLORFENYLISOKYANAT (CZECH)
4-Isocyanato chlorobenzene
4-Chloro-iso-cyanatobenzene
UNII-W46XL60WI8
benzene,1-chloro-4-isocyanato
pChlorfenylisokyanat
MFCD00002024
p-chlorophenylisocvanate
p-chlorophenylisocyanate
4Chloroisocyanatobenzene
pChlorophenyl isocyanate
p-chlorphenyl isocyanate
4-chlorophenyl isocynate
p- chlorophenylisocyanate
p-chloro phenylisocyanate
1Chloro4isocyanatobenzene
4-chiorophenyl isocyanate
4-chloro phenylisocyanate
4-chloro-phenylisocyanate
4-chlorophenyl-isocyanate
WLN: OCNR DG
4-chlorophenyl -isocynate
paraChlorophenyl isocyanate
4-chloro phenyl isocyanate
4-chloro-phenyl isocyanate
Benzene, 1chloro4isocyanato
1-chloro-4-isocyanatobenzen
SCHEMBL77660
1-chloro-4 isocyanato-benzene
4-chloro-1-isocyanato benzene
4-chloro-1-isocyanato-benzene
CHEMBL1865294
4-Chlorophenyl isocyanate, 98%
1-chloranyl-4-isocyanato-benzene
Isocyanic acid, pchlorophenyl ester
BCP29164
NSC76589
Isocyanic Acid 4-Chlorophenyl Ester
Tox21_300991
BBL012220
STL163561
AKOS000121897
NCGC00164343-01
NCGC00164343-02
NCGC00254893-01
CAS-104-12-1
VS-03241
DB-014008
I0121
NS00006206
EN300-19003
D78335
A800902
1-Chloro-4-isocyanatobenzene;p-Chlorophenyl isocyanate
Q26840784
F2190-0546
Z104472166
203-176-9