440663
4-(2-Chloroacetamido)benzoic acid
97%
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About This Item
Linear Formula:
ClCH2CONHC6H4CO2H
CAS Number:
Molecular Weight:
213.62
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
Product Name
4-(2-Chloroacetamido)benzoic acid, 97%
InChI
1S/C9H8ClNO3/c10-5-8(12)11-7-3-1-6(2-4-7)9(13)14/h1-4H,5H2,(H,11,12)(H,13,14)
SMILES string
OC(=O)c1ccc(NC(=O)CCl)cc1
InChI key
FNXAWVZXABMYRM-UHFFFAOYSA-N
assay
97%
mp
264 °C (dec.) (lit.)
functional group
amide
carboxylic acid
chloro
General description
Synthesis of 4-(2-Chloroacetamido)benzoic acid has been reported. It is reported as key intermediate in the synthesis of series of Matijing-Su (MTS, N-(N-benzoyl-L-phenylalanyl)-O-acetyl-L-phenylalanol) derivatives.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Jingying Qiu et al.
Bioorganic & medicinal chemistry, 19(18), 5352-5360 (2011-08-30)
A series of Matijing-Su (MTS, N-(N-benzoyl-l-phenylalanyl)-O-acetyl-L-phenylalanol) derivatives were synthesized and evaluated for their anti-hepatitis B virus (HBV) activity in 2.2.15 cells. The IC(50) of compounds 14a (0.71 μM), 13c (2.85 μM), 13b (4.37 μM), etc. and the selective index of
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