5-Bromo-3,3-dimethyl-1-indanone

Name: 5-Bromo-3,3-dimethyl-1-indanone
Brand: ChemScene
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CAS No. 67159-85-7
Cat. No. CS-0147252
Purity≥98%
MDL No.None

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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+

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5-Bromo-3,3-dimethyl-1-indanone|CS-0147252

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General Information

CAS No. 67159-85-7
Cat. No. CS-0147252
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₁₁BrO
Molecular Weight 239.11
Synonym(s) 5-bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-one
SMILES O=C1CC(C)(C)C2=C1C=CC(Br)=C2

Description

5-Bromo-3,3-dimethyl-1-indanone features a sterically hindered cyclohexanone core with a bromine substituent at the 5-position and two methyl groups at the 3-position, enhancing stability and directing electrophilic substitution. This indanone scaffold serves as a robust building block in synthetic organic chemistry, particularly for constructing complex polycyclic frameworks under mild conditions.

Application

5-Bromo-3,3-dimethyl-1-indanone serves as a versatile building block in medicinal chemistry and synthetic organic research. The bromine substituent enables facile cross-coupling reactions, while the sterically hindered 3,3-dimethyl group enhances bench stability and reduces undesired side reactions. Its indanone core functions effectively in heterocycle synthesis and provides a rigid scaffold for bioactive molecule development.

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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Computational Chemistry Data

TPSA 17.07
LogP 3.3131
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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5-Bromo-3,3-dimethyl-1-indanone

CAS No. 67159-85-7

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