Benzene, 1-bromo-2,3,4-trimethoxy-


Chemical Name: Benzene, 1-bromo-2,3,4-trimethoxy-
CAS Number: 10385-36-1
Product Number: AG003FCU(AGN-PC-0JNTSB)
Synonyms:
MDL No:
Molecular Formula: C9H11BrO3
Molecular Weight: 247.0858

Identification/Properties


Properties
BP:
263.9°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.549(lit.)
Computed Properties
Molecular Weight:
247.088g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
245.989g/mol
Monoisotopic Mass:
245.989g/mol
Topological Polar Surface Area:
27.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
154
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:
Warning
UN#:
N/A
Hazard Statements:
H302-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-Bromo-2,3,4-trimethoxybenzene, a versatile compound, plays a crucial role in chemical synthesis as a key intermediate in the production of various complex organic molecules. It serves as a valuable building block in the creation of pharmaceuticals, agrochemicals, and materials with specialized properties. This compound's unique structure facilitates selective functionalization reactions, enabling chemists to manipulate its chemical properties to design novel molecules with specific characteristics. Its presence in chemical synthesis unlocks a pathway for the development of advanced materials and compounds that have the potential to impact multiple industries.