Name: Name:6-bromo-4-(butan-2-yl)-7-fluoro-1,2,3,4-tetrahydroquinoxalin-2-one
Brand: Angene
SKU: AG01BBV3
Rating: 90 (10 reviews)

6-bromo-4-(butan-2-yl)-7-fluoro-1,2,3,4-tetrahydroquinoxalin-2-one

CAS No.:

1714857-06-3

Catalog Number:

AG01BBV3

Molecular Formula:

C12H14BrFN2O

Molecular Weight:

301.1548

Catalog Number:

AG01BBV3

Chemical Name:

6-bromo-4-(butan-2-yl)-7-fluoro-1,2,3,4-tetrahydroquinoxalin-2-one

CAS Number:

1714857-06-3

Molecular Formula:

C12H14BrFN2O

Molecular Weight:

301.1548

MDL Number:

MFCD27429259

IUPAC Name:

6-bromo-4-butan-2-yl-7-fluoro-1,3-dihydroquinoxalin-2-one

InChI:

InChI=1S/C12H14BrFN2O/c1-3-7(2)16-6-12(17)15-10-5-9(14)8(13)4-11(10)16/h4-5,7H,3,6H2,1-2H3,(H,15,17)

InChI Key:

OHIBATOLLBSFMX-UHFFFAOYSA-N

SMILES:

CC(N1CC(=O)Nc2c1cc(Br)c(c2)F)CC

Complexity:

302

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

300.027g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.159g/mol

Monoisotopic Mass:

300.027g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

32.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1