Name: Name:ethyl 2-bromo-5-(trifluoromethyl)-1H-imidazole-4-carboxylate
Brand: Angene
SKU: AG00I8FE
Rating: 90 (10 reviews)

ethyl 2-bromo-5-(trifluoromethyl)-1H-imidazole-4-carboxylate

CAS No.:

444326-49-2

Catalog Number:

AG00I8FE

Molecular Formula:

C7H6BrF3N2O2

Molecular Weight:

287.0339

Catalog Number:

AG00I8FE

Chemical Name:

ethyl 2-bromo-5-(trifluoromethyl)-1H-imidazole-4-carboxylate

CAS Number:

444326-49-2

Molecular Formula:

C7H6BrF3N2O2

Molecular Weight:

287.0339

MDL Number:

MFCD26407332

IUPAC Name:

ethyl 2-bromo-5-(trifluoromethyl)-1H-imidazole-4-carboxylate

InChI:

InChI=1S/C7H6BrF3N2O2/c1-2-15-5(14)3-4(7(9,10)11)13-6(8)12-3/h2H2,1H3,(H,12,13)

InChI Key:

VHSMVVWMAHWZER-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1nc([nH]c1C(F)(F)F)Br

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

285.956g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

287.036g/mol

Monoisotopic Mass:

285.956g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6