Name: Name:5-methyl-3-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxylic acid
Brand: Angene
SKU: AG01BD14
Rating: 90 (10 reviews)

5-methyl-3-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxylic acid

CAS No.:

943130-82-3

Catalog Number:

AG01BD14

Molecular Formula:

C12H8F3NO3

Molecular Weight:

271.1920

Catalog Number:

AG01BD14

Chemical Name:

5-methyl-3-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxylic acid

CAS Number:

943130-82-3

Molecular Formula:

C12H8F3NO3

Molecular Weight:

271.1920

MDL Number:

MFCD07376124

IUPAC Name:

5-methyl-3-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxylic acid

InChI:

InChI=1S/C12H8F3NO3/c1-6-9(11(17)18)10(16-19-6)7-2-4-8(5-3-7)12(13,14)15/h2-5H,1H3,(H,17,18)

InChI Key:

AQMLVWABNFLPPA-UHFFFAOYSA-N

SMILES:

OC(=O)c1c(C)onc1c1ccc(cc1)C(F)(F)F

Complexity:

340

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

271.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.195g/mol

Monoisotopic Mass:

271.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8