3-Bromo-5-nitroanisole

Name: 3-Bromo-5-nitroanisole
Brand: ChemScene
Availability: InStock
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CAS No. 16618-67-0
Cat. No. CS-M0503
Purity≥98%
MDL No.MFCD04112752

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

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Structure of 16618-67-0

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Description

3-Bromo-5-nitroanisole features a bromine atom flanked by a nitro group and a methoxy substituent on the aromatic ring, enabling selective cross-coupling reactions. This electronic configuration enhances reactivity in palladium-catalyzed transformations while maintaining stability under standard bench conditions.

Application

3-Bromo-5-nitroanisole serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling palladium-catalyzed cross-coupling reactions due to its orthogonal reactivity profile. The bromo group facilitates reliable C–C bond formation, while the nitro and methoxy functionalities provide predictable electronic modulation and compatibility with standard protecting group strategies. Its bench-stable nature and ease of purification support efficient downstream transformations in multi-step syntheses.

General Information

CAS No. 16618-67-0
Cat. No. CS-M0503
Purity ≥98%
MDL No. MFCD04112752
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₆BrNO₃
Molecular Weight 232.03
Synonym(s) 1-Bromo-3-methoxy-5-nitrobenzene
SMILES BrC1=CC([N+]([O-])=O)=CC(OC)=C1

Computational Chemistry Data

TPSA 52.37
LogP 2.3659
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 2

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Bromo-5-nitroanisole

CAS No. 16618-67-0

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