1-Bromo-2-methyl-3-nitrobenzene

Name: 1-Bromo-2-methyl-3-nitrobenzene
Brand: ChemScene
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CAS No. 55289-35-5
Cat. No. CS-W014875
Purity≥98%
MDL No.MFCD00009792

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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1-Bromo-2-methyl-3-nitrobenzene|CS-W014875

Structure of 55289-35-5

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Description

2-Bromo-6-nitrotoluene has been used:as starting reagent in total synthesis of N-acetyl methyl ester of ()-clavicipitic acidsin synthesis of carbazomadurin A, highly oxygenated neuronal cell protecting carbazole alkaloid

Application

1-Bromo-2-methyl-3-nitrobenzene serves as a versatile building block in medicinal chemistry and heterocyclic synthesis, enabling palladium-catalyzed cross-coupling reactions due to its well-established reactivity profile. The ortho-bromine and meta-nitro groups provide orthogonal functionalization sites, while the methyl group enhances metabolic stability. Its bench-stable nature and compatibility with standard reaction conditions facilitate efficient access to complex aromatic scaffolds.

General Information

CAS No. 55289-35-5
Cat. No. CS-W014875
Purity ≥98%
MDL No. MFCD00009792
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₆BrNO₂
Molecular Weight 216.03
Synonym(s) None
SMILES O=[N+](C1=C(C)C(Br)=CC=C1)[O-]

Computational Chemistry Data

TPSA 43.14
LogP 2.66572
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 1

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Other Classifications

Bioactive Molecules Dye and Bio-assay Reagents

Building Blocks Functional Group Nitro compounds

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1-Bromo-2-methyl-3-nitrobenzene

CAS No. 55289-35-5

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