Name: Name:Methanesulfonic acid, trifluoro-, 2-chloro-4-formylphenyl ester
Brand: Angene
SKU: AG00I1WK
Rating: 90 (10 reviews)

Methanesulfonic acid, trifluoro-, 2-chloro-4-formylphenyl ester

CAS No.:

188112-72-3

Catalog Number:

AG00I1WK

Molecular Formula:

C8H4ClF3O4S

Molecular Weight:

288.6282

Catalog Number:

AG00I1WK

Chemical Name:

Methanesulfonic acid, trifluoro-, 2-chloro-4-formylphenyl ester

CAS Number:

188112-72-3

Molecular Formula:

C8H4ClF3O4S

Molecular Weight:

288.6282

MDL Number:

MFCD28991832

IUPAC Name:

(2-chloro-4-formylphenyl) trifluoromethanesulfonate

InChI:

InChI=1S/C8H4ClF3O4S/c9-6-3-5(4-13)1-2-7(6)16-17(14,15)8(10,11)12/h1-4H

InChI Key:

HHKQCFPEKNHWQN-UHFFFAOYSA-N

SMILES:

O=Cc1ccc(c(c1)Cl)OS(=O)(=O)C(F)(F)F

Complexity:

375

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

287.947g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

288.621g/mol

Monoisotopic Mass:

287.947g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8