Name: Name:2-(2-amino-4-fluorophenyl)-octahydro-1H-isoindole-1,3-dione
Brand: Angene
SKU: AG019UJA
Rating: 90 (10 reviews)

2-(2-amino-4-fluorophenyl)-octahydro-1H-isoindole-1,3-dione

CAS No.:

954582-72-0

Catalog Number:

AG019UJA

Molecular Formula:

C14H15FN2O2

Molecular Weight:

262.2795

Catalog Number:

AG019UJA

Chemical Name:

2-(2-amino-4-fluorophenyl)-octahydro-1H-isoindole-1,3-dione

CAS Number:

954582-72-0

Molecular Formula:

C14H15FN2O2

Molecular Weight:

262.2795

MDL Number:

MFCD09741752

IUPAC Name:

2-(2-amino-4-fluorophenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

InChI:

InChI=1S/C14H15FN2O2/c15-8-5-6-12(11(16)7-8)17-13(18)9-3-1-2-4-10(9)14(17)19/h5-7,9-10H,1-4,16H2

InChI Key:

QGNWTCQLEPCORK-UHFFFAOYSA-N

SMILES:

Fc1ccc(c(c1)N)N1C(=O)C2C(C1=O)CCCC2

Complexity:

377

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

262.112g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

262.284g/mol

Monoisotopic Mass:

262.112g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8