Name: Name:2-{4-[(2,2,2-trifluoroethyl)sulfanyl]phenyl}acetic acid
Brand: Angene
SKU: AG01AUFA
Rating: 90 (10 reviews)

2-{4-[(2,2,2-trifluoroethyl)sulfanyl]phenyl}acetic acid

CAS No.:

1343705-05-4

Catalog Number:

AG01AUFA

Molecular Formula:

C10H9F3O2S

Molecular Weight:

250.2375

Catalog Number:

AG01AUFA

Chemical Name:

2-{4-[(2,2,2-trifluoroethyl)sulfanyl]phenyl}acetic acid

CAS Number:

1343705-05-4

Molecular Formula:

C10H9F3O2S

Molecular Weight:

250.2375

MDL Number:

MFCD20438505

IUPAC Name:

2-[4-(2,2,2-trifluoroethylsulfanyl)phenyl]acetic acid

InChI:

InChI=1S/C10H9F3O2S/c11-10(12,13)6-16-8-3-1-7(2-4-8)5-9(14)15/h1-4H,5-6H2,(H,14,15)

InChI Key:

SJGIDCUCFVATDL-UHFFFAOYSA-N

SMILES:

OC(=O)Cc1ccc(cc1)SCC(F)(F)F

Complexity:

235

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

250.028g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

250.235g/mol

Monoisotopic Mass:

250.028g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2