Name: Name:Cyclopentanecarboxylic acid, 2-(4-fluorophenyl)-4-oxo-, trans-
Brand: Angene
SKU: AG01CCU9
Rating: 90 (10 reviews)

Cyclopentanecarboxylic acid, 2-(4-fluorophenyl)-4-oxo-, trans-

CAS No.:

104201-85-6

Catalog Number:

AG01CCU9

Molecular Formula:

C12H11FO3

Molecular Weight:

222.2123

Catalog Number:

AG01CCU9

Chemical Name:

Cyclopentanecarboxylic acid, 2-(4-fluorophenyl)-4-oxo-, trans-

CAS Number:

104201-85-6

Molecular Formula:

C12H11FO3

Molecular Weight:

222.2123

MDL Number:

MFCD31630921

IUPAC Name:

2-(4-fluorophenyl)-4-oxocyclopentane-1-carboxylic acid

InChI:

InChI=1S/C12H11FO3/c13-8-3-1-7(2-4-8)10-5-9(14)6-11(10)12(15)16/h1-4,10-11H,5-6H2,(H,15,16)

InChI Key:

GBHRFYWHAGRHBU-UHFFFAOYSA-N

SMILES:

O=C1C[C@H]([C@@H](C1)c1ccc(cc1)F)C(=O)O

Complexity:

295

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

222.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

222.215g/mol

Monoisotopic Mass:

222.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1