AG000BA9

114417-34-4 | 4(1H)-Quinolinone, 7-bromo-2,3-dihydro-

AG000BA9

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CAS Number	114417-34-4
Catalog Number	AG000BA9(AGN-PC-001JQH)
Chemical Name	4(1H)-Quinolinone, 7-bromo-2,3-dihydro-
IUPAC Name	7-bromo-2,3-dihydro-1H-quinolin-4-one
InChI	InChI=1S/C9H8BrNO/c10-6-1-2-7-8(5-6)11-4-3-9(7)12/h1-2,5,11H,3-4H2
InChI Key	MZRDGUADMZHLRW-UHFFFAOYSA-N
MDL Number	MFCD12028725
Molecular Formula	C9H8BrNO
Molecular Weight	226.0699
SMILES	O=C1CCNC2=C1C=CC(Br)=C2
Synonyms	7-bromo-2,3-dihydroquinolin-4(1H)-one, 114417-34-4, 4(1H)-Quinolinone, 7-bromo-2,3-dihydro-, 7-BROMO-2,3-DIHYDRO-1H-QUINOLIN-4-ONE, SCHEMBL16794237, DTXSID70561052, 3670AJ, MFCD12028725, ZINC38665639, AKOS022687699, FCH1375049, QC-5263, AJ-96811, AK155282, AS-41316, SC-52235, AB0047214, AX8289864, ST24045589, Z-7031, C9H8BrNO,

Complexity	195
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.979g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	226.073g/mol
Monoisotopic Mass	224.979g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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