Name: Name:1(2H)-Isoquinolinone, 4-bromo-6-fluoro-
Brand: Angene
SKU: AG000JEF
Rating: 90 (10 reviews)

1(2H)-Isoquinolinone, 4-bromo-6-fluoro-

CAS No.:

1227607-99-9

Catalog Number:

AG000JEF

Molecular Formula:

C9H5BrFNO

Molecular Weight:

242.0445

Catalog Number:

AG000JEF

Chemical Name:

1(2H)-Isoquinolinone, 4-bromo-6-fluoro-

CAS Number:

1227607-99-9

Molecular Formula:

C9H5BrFNO

Molecular Weight:

242.0445

MDL Number:

MFCD14706174

IUPAC Name:

4-bromo-6-fluoro-2H-isoquinolin-1-one

InChI:

InChI=1S/C9H5BrFNO/c10-8-4-12-9(13)6-2-1-5(11)3-7(6)8/h1-4H,(H,12,13)

InChI Key:

LLHQSKGXDXYXJD-UHFFFAOYSA-N

SMILES:

Fc1ccc2c(c1)c(Br)c[nH]c2=O

Complexity:

266

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.954g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.047g/mol

Monoisotopic Mass:

240.954g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8