366625
5-Fluoro-2-methylbenzoic acid
99%
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About This Item
Linear Formula:
FC6H3(CH3)CO2H
CAS Number:
Molecular Weight:
154.14
UNSPSC Code:
12352100
PubChem Substance ID:
MDL number:
Assay:
99%
InChI
1S/C8H7FO2/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4H,1H3,(H,10,11)
SMILES string
Cc1ccc(F)cc1C(O)=O
InChI key
JVBLXLBINTYFPR-UHFFFAOYSA-N
assay
99%
mp
130-132 °C (lit.)
functional group
carboxylic acid, fluoro
Application
5-Fluoro-2-methylbenzoic acid may be used in the preparation of:
- 5-fluoro-3-hydroxy-2-methylbenzoic acid
- 5-fluoro-2-methyl-3-nitrobenzoic acid methyl ester
- 5-fluoro-N,2-dimethylbenzamide
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
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Multkilogram Scale-Up of a Reductive Alkylation Route to a Novel PARP Inhibitor.
Gillmore AT, et al.
Organic Process Research & Development, 16(12), 2063-2072 (1999)
Xing Fan et al.
Bioorganic & medicinal chemistry, 19(16), 4935-4952 (2011-07-23)
HIV-1 integrase (IN) is a validated therapeutic target for antiviral drug design. However, the emergence of viral strains resistant to clinically studied IN inhibitors demands the discovery of novel inhibitors that are structurally as well mechanistically different. Herein, we describe
E Takashiro et al.
Bioorganic & medicinal chemistry, 7(9), 2063-2072 (1999-10-26)
The structure-activity relationship of HIV-1 protease (HIV-1 PR) inhibitors containing alpha-hydroxy-beta-amino acids is discussed. We demonstrated that substituent groups on the P1 aromatic rings of the inhibitors exert significant influence on their biological activity. Inhibitors bearing an alkyl or a
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