2-chloro-4-propan-2-yloxyaniline


Chemical Name: 2-chloro-4-propan-2-yloxyaniline
CAS Number: 1071989-24-6
Product Number: AG01AG5U(AGN-PC-0EEO55)
Synonyms:
MDL No:
Molecular Formula: C9H12ClNO
Molecular Weight: 185.6507

Identification/Properties


Computed Properties
Molecular Weight:
185.651g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
185.061g/mol
Monoisotopic Mass:
185.061g/mol
Topological Polar Surface Area:
35.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
141
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:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Chloro-4-isopropoxyaniline is widely utilized in chemical synthesis as a versatile building block for the production of various organic compounds. This compound is commonly employed in the pharmaceutical industry for the synthesis of novel drug candidates and active pharmaceutical ingredients. Its unique chemical structure and reactivity make it a valuable intermediate in the creation of complex molecules with diverse biological activities. Additionally, 2-Chloro-4-isopropoxyaniline is utilized in the development of agrochemicals and specialty chemicals due to its ability to introduce specific functional groups into target molecules. In organic chemistry, this compound serves as a key starting material for the preparation of advanced materials and fine chemicals, showcasing its importance in the realm of chemical synthesis.