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About This Item
Linear Formula:
ClCO2C6H4Br
CAS Number:
Molecular Weight:
235.46
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
Recommended Products
Assay
96%
form
liquid
refractive index
n20/D 1.5575 (lit.)
bp
118 °C/12 mmHg (lit.)
density
1.648 g/mL at 25 °C (lit.)
storage temp.
2-8°C
SMILES string
ClC(=O)Oc1ccc(Br)cc1
InChI
1S/C7H4BrClO2/c8-5-1-3-6(4-2-5)11-7(9)10/h1-4H
InChI key
IKMNJYGTSSQNSE-UHFFFAOYSA-N
Application
4-Bromophenyl chloroformate was used in the synthesis of novel diazabicyclic analogs, 1,5-diazabicyclo[4.2.2]decane carbamate and 1,4-diazabicyclo[4.2.2]decane carbamate.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 3 Oral - Eye Dam. 1 - Skin Corr. 1B
Storage Class Code
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
WGK
WGK 3
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Christopher J O'Donnell et al.
Bioorganic & medicinal chemistry letters, 19(16), 4747-4751 (2009-07-07)
The synthesis and SAR studies about the bicyclic amine, carbamate linker and aromatic ring of a 1,4-diazabicyclo[3.2.2]nonane phenyl carbamate series of alpha7 nAChR agonists is described. The development of the medicinal chemistry strategy and SAR which led to the identification
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