Name: Name:HYDROXY-(3,4,5-TRIFLUORO-PHENYL)-ACETIC ACID METHYL ESTER
Brand: Angene
SKU: AG01E3MU
Rating: 90 (10 reviews)

HYDROXY-(3,4,5-TRIFLUORO-PHENYL)-ACETIC ACID METHYL ESTER

CAS No.:

949167-51-5

Catalog Number:

AG01E3MU

Molecular Formula:

C9H7F3O3

Molecular Weight:

220.1453

Catalog Number:

AG01E3MU

Chemical Name:

HYDROXY-(3,4,5-TRIFLUORO-PHENYL)-ACETIC ACID METHYL ESTER

CAS Number:

949167-51-5

Molecular Formula:

C9H7F3O3

Molecular Weight:

220.1453

MDL Number:

MFCD17284758

IUPAC Name:

methyl 2-hydroxy-2-(3,4,5-trifluorophenyl)acetate

InChI:

InChI=1S/C9H7F3O3/c1-15-9(14)8(13)4-2-5(10)7(12)6(11)3-4/h2-3,8,13H,1H3

InChI Key:

GRLVURMSJQTVKI-UHFFFAOYSA-N

SMILES:

COC(=O)C(c1cc(F)c(c(c1)F)F)O

Complexity:

225

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.147g/mol

Monoisotopic Mass:

220.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5