Benzoyl chloride, 3,5-dimethoxy-


Chemical Name: Benzoyl chloride, 3,5-dimethoxy-
CAS Number: 17213-57-9
Product Number: AG003INV(AGN-PC-0JLWIG)
Synonyms:
MDL No:
Molecular Formula: C9H9ClO3
Molecular Weight: 200.6190

Identification/Properties


Properties
MP:
43-46 °C(lit.)
BP:
157-158 °C16 mm Hg(lit.)
Storage:
Room Temperature;
Form:
Solid
Stability:
Moisture Sensitive
Refractive Index:
1.5230 (estimate)
Computed Properties
Molecular Weight:
200.618g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
200.024g/mol
Monoisotopic Mass:
200.024g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
172
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:
Signal Word:
Danger
UN#:
3261
Hazard Statements:
H314
Precautionary Statements:
P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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Chemical Structure



3,5-Dimethoxybenzoylchloride, a key chemical intermediate in organic synthesis, is a versatile compound widely utilized in various chemical reactions. This compound is commonly employed as an acylating agent in the synthesis of complex organic molecules. Its ability to introduce the 3,5-dimethoxybenzoyl group into organic frameworks makes it a valuable tool in the development of pharmaceuticals, agrochemicals, and materials science. With its efficient acylating properties, 3,5-Dimethoxybenzoylchloride is essential for the preparation of esters, amides, and other derivatives through acylation reactions. Its role in chemical synthesis extends to the creation of diverse compounds with unique structural and functional properties, contributing significantly to the advancement of modern synthetic chemistry.