Name: Name:2-bromo-1-(isoquinolin-1-yl)ethan-1-one
Brand: Angene
SKU: AG01BBU6
Rating: 90 (10 reviews)

2-bromo-1-(isoquinolin-1-yl)ethan-1-one

CAS No.:

894854-73-0

Catalog Number:

AG01BBU6

Molecular Formula:

C11H8BrNO

Molecular Weight:

250.0913

Catalog Number:

AG01BBU6

Chemical Name:

2-bromo-1-(isoquinolin-1-yl)ethan-1-one

CAS Number:

894854-73-0

Molecular Formula:

C11H8BrNO

Molecular Weight:

250.0913

MDL Number:

MFCD23715574

IUPAC Name:

2-bromo-1-isoquinolin-1-ylethanone

InChI:

InChI=1S/C11H8BrNO/c12-7-10(14)11-9-4-2-1-3-8(9)5-6-13-11/h1-6H,7H2

InChI Key:

NANYLNYMOOKXSH-UHFFFAOYSA-N

SMILES:

BrCC(=O)c1nccc2c1cccc2

Complexity:

219

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

248.979g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

250.095g/mol

Monoisotopic Mass:

248.979g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

30A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1