9-Bromo-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine

Name: 9-Bromo-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine
Brand: ChemScene
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CAS No. 1282516-67-9
Cat. No. CS-B1758
Purity≥98%
MDL No.MFCD22372760

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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+
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9-Bromo-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine|CS-B1758

Structure of 1282516-67-9

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General Information

CAS No. 1282516-67-9
Cat. No. CS-B1758
Purity ≥98%
MDL No. MFCD22372760
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₉BrN₂O
Molecular Weight 265.11
Synonym(s) None
SMILES BrC1=CC=C2C(OCCN3C=CN=C23)=C1

Description

9-Bromo-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine features a brominated imidazobenzoxazepine core with enhanced stability and solubility in organic media. This scaffold integrates readily into medicinal chemistry campaigns targeting CNS modulators, offering high functional group tolerance and compatibility with palladium-catalyzed cross-coupling reactions.

Application

9-Bromo-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine serves as a versatile building block for the synthesis of bioactive heterocycles, enabling palladium-catalyzed cross-coupling reactions due to its stable bromo functionality. The dihydroimidazo[1,2-d][1,4]benzoxazepine core offers enhanced solubility and bench stability, facilitating purification and integration into complex molecular architectures. Its functional group tolerance supports downstream modifications in 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 : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

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Computational Chemistry Data

TPSA 27.05
LogP 2.705
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 0

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Imidazole compounds

Key Words

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9-Bromo-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine

CAS No. 1282516-67-9

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