AG000FU5

1150618-23-7 | Ethanone, 1-(3-bromo-6-quinolinyl)-

AG000FU5

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CAS Number	1150618-23-7
Catalog Number	AG000FU5(AGN-PC-05VCE6)
Chemical Name	Ethanone, 1-(3-bromo-6-quinolinyl)-
IUPAC Name	1-(3-bromoquinolin-6-yl)ethanone
InChI	InChI=1S/C11H8BrNO/c1-7(14)8-2-3-11-9(4-8)5-10(12)6-13-11/h2-6H,1H3
InChI Key	AYEUSAZLYWJBOM-UHFFFAOYSA-N
MDL Number	MFCD12024483
Molecular Formula	C11H8BrNO
Molecular Weight	250.0913
SMILES	CC(=O)C1=CC2=C(C=C1)N=CC(Br)=C2
Synonyms	1-(3-bromoquinolin-6-yl)ethanone, 1150618-23-7, 1-(3-Bromoquinolin-6-yl)ethan-1-one, SCHEMBL15447361, DTXSID20653976, 1-(3-bromo-6-quinolinyl)ethanone, KS-00000PR3, 2482AA, MFCD12024483, ZINC32914916, 1-(3-bromanylquinolin-6-yl)ethanone, AKOS015919386, DS-4386, Ethanone, 1-(3-bromo-6-quinolinyl)-, AJ-85679, AK109658, SC-53502, CS-0041442, FT-0655331, ST24037204, A803345, S08-0023, C11H8BrNO,

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	248.979g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	250.095g/mol
Monoisotopic Mass	248.979g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number