3-Bromo-1-indanone

Name: 3-Bromo-1-indanone
Brand: ChemScene
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CAS No. 40774-41-2
Cat. No. CS-W003645
Purity≥95%
MDL No.MFCD09800595

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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 40774-41-2

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General Information

CAS No. 40774-41-2
Cat. No. CS-W003645
Purity ≥95%
MDL No. MFCD09800595
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₇BrO
Molecular Weight 211.06
Synonym(s) 3-Bromoindan-1-one
SMILES BrC(C1=CC=CC=C12)CC2=O

Description

3-Bromo-1-indanone is a brominated indanone derivative featuring a reactive ketone group flanked by a bromine substituent at the 3-position. This structural motif enables direct functionalization in cross-coupling reactions and facilitates incorporation into complex molecular architectures under standard conditions. The compound exhibits stability under ambient handling and serves as a key intermediate in synthetic organic chemistry workflows.

Application

3-Bromo-1-indanone serves as a versatile building block in synthetic organic chemistry, enabling efficient access to functionalized indane scaffolds. Its bromine substituent facilitates palladium-catalyzed cross-coupling reactions, while the ketone group supports nucleophilic additions and enolate chemistry. The compound exhibits good bench stability and is compatible with a range of standard reaction conditions, making it well-suited for medicinal chemistry and process development workflows.

Safety Information

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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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Computational Chemistry Data

TPSA 17.07
LogP 2.709
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 0

Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Bromo-1-indanone

CAS No. 40774-41-2

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