1-[2-[4-(chloromethyl)phenoxy]ethyl]azepane;hydrochloride


Chemical Name: 1-[2-[4-(chloromethyl)phenoxy]ethyl]azepane;hydrochloride
CAS Number: 223251-25-0
Product Number: AG00I4EA(AGN-PC-0MV33U)
Synonyms:
MDL No:
Molecular Formula: C15H23Cl2NO
Molecular Weight: 304.25522

Identification/Properties


Computed Properties
Molecular Weight:
304.255g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
5
Exact Mass:
303.116g/mol
Monoisotopic Mass:
303.116g/mol
Topological Polar Surface Area:
12.5A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
209
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



1-(2-(4-(Chloromethyl)phenoxy)ethyl)azepane hydrochloride is a valuable compound in chemical synthesis, particularly in the field of medicinal chemistry. This compound serves as a key building block in the creation of various pharmaceutical agents and biologically active molecules. Its unique structure and reactivity make it a versatile intermediate for the synthesis of complex organic compounds with specific pharmacological properties. By utilizing this compound in chemical reactions, researchers can efficiently access novel chemical structures that have the potential for therapeutic applications in the treatment of various diseases.