Name: Name:Benzoic acid, 4-azido-2,3,5,6-tetrafluoro-, methyl ester
Brand: Angene
SKU: AG0017I4
Rating: 90 (10 reviews)

Benzoic acid, 4-azido-2,3,5,6-tetrafluoro-, methyl ester

CAS No.:

122590-75-4

Catalog Number:

AG0017I4

Molecular Formula:

C8H3F4N3O2

Molecular Weight:

249.1219

Catalog Number:

AG0017I4

Chemical Name:

Benzoic acid, 4-azido-2,3,5,6-tetrafluoro-, methyl ester

CAS Number:

122590-75-4

Molecular Formula:

C8H3F4N3O2

Molecular Weight:

249.1219

MDL Number:

MFCD07369498

IUPAC Name:

methyl 4-azido-2,3,5,6-tetrafluorobenzoate

InChI:

InChI=1S/C8H3F4N3O2/c1-17-8(16)2-3(9)5(11)7(14-15-13)6(12)4(2)10/h1H3

InChI Key:

CGSQBDQXCKRZQT-UHFFFAOYSA-N

SMILES:

[N-]=[N+]=Nc1c(F)c(F)c(c(c1F)F)C(=O)OC

Complexity:

334

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.016g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.125g/mol

Monoisotopic Mass:

249.016g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1