Name: Name:Methanesulfonic acid, 1,1,1-trifluoro-, 4-chloro-2-methylphenyl ester
Brand: Angene
SKU: AG001JTY
Rating: 90 (10 reviews)

Methanesulfonic acid, 1,1,1-trifluoro-, 4-chloro-2-methylphenyl ester

CAS No.:

1446016-75-6

Catalog Number:

AG001JTY

Molecular Formula:

C8H6ClF3O3S

Molecular Weight:

274.6446

Catalog Number:

AG001JTY

Chemical Name:

Methanesulfonic acid, 1,1,1-trifluoro-, 4-chloro-2-methylphenyl ester

CAS Number:

1446016-75-6

Molecular Formula:

C8H6ClF3O3S

Molecular Weight:

274.6446

MDL Number:

MFCD25541852

IUPAC Name:

(4-chloro-2-methylphenyl) trifluoromethanesulfonate

InChI:

InChI=1S/C8H6ClF3O3S/c1-5-4-6(9)2-3-7(5)15-16(13,14)8(10,11)12/h2-4H,1H3

InChI Key:

GECYAQNQPGLIHX-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)C)OS(=O)(=O)C(F)(F)F

Complexity:

335

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

273.968g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

274.638g/mol

Monoisotopic Mass:

273.968g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7