Name: Name:8-Bromo-3,4-dihydroisoquinolin-1(2h)-one
Brand: Angene
SKU: AG008XQR
Rating: 90 (10 reviews)

8-Bromo-3,4-dihydroisoquinolin-1(2h)-one

CAS No.:

1159811-99-0

Catalog Number:

AG008XQR

Molecular Formula:

C9H8BrNO

Molecular Weight:

226.0699

Catalog Number:

AG008XQR

Chemical Name:

8-Bromo-3,4-dihydroisoquinolin-1(2h)-one

CAS Number:

1159811-99-0

Molecular Formula:

C9H8BrNO

Molecular Weight:

226.0699

MDL Number:

MFCD12400935

IUPAC Name:

8-bromo-3,4-dihydro-2H-isoquinolin-1-one

InChI:

InChI=1S/C9H8BrNO/c10-7-3-1-2-6-4-5-11-9(12)8(6)7/h1-3H,4-5H2,(H,11,12)

InChI Key:

KNOUCIUGFVUKRP-UHFFFAOYSA-N

SMILES:

O=C1NCCc2c1c(Br)ccc2

Complexity:

195

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.979g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

226.073g/mol

Monoisotopic Mass:

224.979g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9