Name: Name:5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID
Brand: AABLOCKS
SKU: AA00D8KS
Rating: 90 (10 reviews)

Catalog No.: AA00D8KS

54022-99-0 | 5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID

Pack Size： 1g

Purity： 95%

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Technical Information

Catalog Number: AA00D8KS

Chemical Name: 5-[3-(TRIFLUOROMETHYL)PHENYL]-2-FUROIC ACID

CAS Number: 54022-99-0

Molecular Formula: C12H7F3O3

Molecular Weight: 256.1774

MDL Number: MFCD00274244

SMILES: OC(=O)c1ccc(o1)c1cccc(c1)C(F)(F)F

Properties

Form: Solid

MP: 199-205°C(lit.)

Complexity: 316

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 18

Hydrogen Bond Acceptor Count: 6

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 3.4

Downstream Synthesis Route

54022-99-0

39067-45-3

3-diethylamino-2,2-dimethylpropyl5-(m-trifluoromethylphenyl)-2-furoatehydrochloride

[1]JournalofPharmaceuticalSciences,1980,vol.69,p.107-110

54022-99-0

33509-43-2

C19H15F3N4O2S

[1]Prasad,D.Jagadeesh;Karthikeyan;Karegoudar,PrakashB.;Poojary,Boja;Holla,B.Shivarama;Kumari,N.Suchetha[Phosphorus,SulfurandSiliconandtheRelatedElements,2007,vol.182,#5,p.1083-1091]

54022-99-0

26020-48-4

1393456-36-4

[1]Hu,Peng;Shang,Yaping;Su,Weiping[AngewandteChemie-InternationalEdition,2012,vol.51,#24,p.5945-5949]

54022-99-0

2827-56-7

1326532-11-9

[1]Bioorganicandmedicinalchemistry,2012,vol.20,p.6384-6393,10

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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