AG009AUC

135631-90-2 | 6-Bromo-3,4-dihydro-4,4-dimethylquinolin-2(1H)-one

AG009AUC

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CAS Number	135631-90-2
Catalog Number	AG009AUC(AGN-PC-0N9KSC)
Chemical Name	6-Bromo-3,4-dihydro-4,4-dimethylquinolin-2(1H)-one
IUPAC Name	6-bromo-4,4-dimethyl-1,3-dihydroquinolin-2-one
InChI	InChI=1S/C11H12BrNO/c1-11(2)6-10(14)13-9-4-3-7(12)5-8(9)11/h3-5H,6H2,1-2H3,(H,13,14)
InChI Key	FTRFIBKHXWYJAW-UHFFFAOYSA-N
MDL Number	MFCD00795100
Molecular Formula	C11H12BrNO
Molecular Weight	254.1231
SMILES	O=C1NC2=C(C=C(Br)C=C2)C(C)(C)C1
Synonyms	135631-90-2, 6-Bromo-3,4-dihydro-4,4-dimethylquinolin-2(1H)-one, 6-bromo-4,4-dimethyl-3,4-dihydroquinolin-2(1H)-one, 6-bromo-4,4-dimethyl-1,3-dihydroquinolin-2-one, 6-Bromo-4,4-dimethyl-3,4-dihydro-1H-quinolin-2-one, 4,4-dimethyl-6-bromo-2-oxo-1,2,3,4-tetrahydroquinoline, AK-27467, W-205470, 6-BROMO-4,4-DIMETHYL-1,2,3,4-TETRAHYDROQUINOLIN-2-ONE, PubChem17960, ACMC-1C1XB, SCHEMBL248152, CTK4B9912, KS-00000FDP, DTXSID30444099, FTRFIBKHXWYJAW-UHFFFAOYSA-N, ANW-19966, MFCD00795100, QC-664, SC2181, ZINC35269828, AKOS015842148, DS-1452, FCH1331952, RP07376, 4,4-dimethyl-6-bromo-2-oxo-quinoline, AJ-90905, AN-32092, BC004318, BR-27467, CJ-18655, SC-32030, AB0035552, AX8108429, DB-063087, ST2412224, TC-068188, 4CH-006814, CS-0046261, FT-0645460, X9922, B-2625, 631B902, I08-579, 6-Bromo-4,4-dimethyl-3 4-dihydro-1H-quinolin-2-one, 6-bromo-4,4-dimethyl-3,4-dihydo-1H-quinolin-2-one, 4,4 -Dimethyl-6-bromo-2-oxo-1,2,3,4-tetrahydroquinoline, 4,4-Dimethyl- 6-bromo-2-oxo-1,2,3,4-tetrahydroquinoline, C11H12BrNO, ACN-049708, CID10729589, 6-BROMO-3,4-DIHYDRO-4,4-DIMETHYLQUINOLIN-2 -ONE,

Complexity	252
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	253.01g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	254.127g/mol
Monoisotopic Mass	253.01g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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