Name: Name:4-[2-amino-4-(trifluoromethyl)phenyl]piperazin-2-one
Brand: Angene
SKU: AG01A03A
Rating: 90 (10 reviews)

4-[2-amino-4-(trifluoromethyl)phenyl]piperazin-2-one

CAS No.:

882672-41-5

Catalog Number:

AG01A03A

Molecular Formula:

C11H12F3N3O

Molecular Weight:

259.2277

Catalog Number:

AG01A03A

Chemical Name:

4-[2-amino-4-(trifluoromethyl)phenyl]piperazin-2-one

CAS Number:

882672-41-5

Molecular Formula:

C11H12F3N3O

Molecular Weight:

259.2277

MDL Number:

MFCD09046843

IUPAC Name:

4-[2-amino-4-(trifluoromethyl)phenyl]piperazin-2-one

InChI:

InChI=1S/C11H12F3N3O/c12-11(13,14)7-1-2-9(8(15)5-7)17-4-3-16-10(18)6-17/h1-2,5H,3-4,6,15H2,(H,16,18)

InChI Key:

XCYHDPGKQQVCEL-UHFFFAOYSA-N

SMILES:

O=C1NCCN(C1)c1ccc(cc1N)C(F)(F)F

Complexity:

321

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

259.093g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.232g/mol

Monoisotopic Mass:

259.093g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4