AG00DEL0

525-76-8 | 2-METHYL-3,1-BENZOXAZA-4-ONE

AG00DEL0

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CAS Number	525-76-8
Catalog Number	AG00DEL0(AGN-PC-069DN9)
Chemical Name	2-METHYL-3,1-BENZOXAZA-4-ONE
EC Number	208-381-7
IUPAC Name	2-methyl-3,1-benzoxazin-4-one
InChI	InChI=1S/C9H7NO2/c1-6-10-8-5-3-2-4-7(8)9(11)12-6/h2-5H,1H3
InChI Key	WMQSKECCMQRJRX-UHFFFAOYSA-N
MDL Number	MFCD00047647
Molecular Formula	C9H7NO2
Molecular Weight	161.1574
SMILES	O=C1C2=CC=CC=C2N=C(C)O1
UNII	Y938TMX1D8
Synonyms	525-76-8, 2-Methyl-4H-benzo[d][1,3]oxazin-4-one, 2-Methyl-4H-3,1-benzoxazin-4-one, 2-Methyl-3,1-benzoxaza-4-one, Acetanthranil, 4H-3,1-Benzoxazin-4-one, 2-methyl-, UNII-Y938TMX1D8, 4H-3,1-Benzoxazin-4-one,2-methyl-, 2-Methyl-4-oxo-4H-3,1-benzoxazine, CHEMBL343202, Y938TMX1D8, 2-methyl-3,1-benzoxazin-4-one, WMQSKECCMQRJRX-UHFFFAOYSA-N, 2-methylbenzo[d]1,3-oxazin-4-one, 4H-3, 2-methyl-, NSC10119, EINECS 208-381-7, NSC 10119, ACETYL ANTHRANIL, AC1Q6MAJ, AC1L29BJ, DSSTox_CID_29269, DSSTox_RID_83388, DSSTox_GSID_49313, SCHEMBL146072, DTXSID0049313, 2-methyl-4oxo-3,1-benzoxazine, CTK4J6121, 2-methyl-4-oxo-3,1-benzoxazine, HMS1785J07, ZINC114133, 2-methyl-[3,1]benzoxazin-4-one, 2-methyl-4-oxo-3, 1-benzoxazine, ALBB-010490, Tox21_202841, 7432AB, BBL000102, BDBM50406209, MFCD00047647, NSC-10119, NSC521353, SBB000135, STK279667, 2-methylbenzo[d][1,3]oxazin-4-one, 2-methyl-4H-3,1-benzoxazine-4-one, AKOS001106895, MCULE-4681569877, NSC-521353, VZ23447, 2-Methyl-benzo[d][1,3]oxazin-4-one, KS-000032Q1, 2-2-Methyl-4H-3,1-benzoxazin-4-one, 2-Methyl-4H-3,1-benzoxazin-4-one #, NCGC00260387-01, AC-12577, AJ-11469, AK122095, CAS-525-76-8, QC-10811, SC-20050, ST025235, ZB003850, 2-methyl 4H-benzo[d][1,3]oxazin-4-one, 2-Methyl-4H-3,1-benzoxazin-4-one, 98%, 2-methyl-4H-benzo [d][1,3]oxazin-4-one, CS-0046639, FT-0632293, R1791, 1M-711, SR-01000531819, SR-01000531819-1, I01-13748, C9H7NO2, C9-H7-N-O2, CID68236, AR-1E3649, 4-Hydroxy-1,5-naphthyridine-3-carboxylic acid, A15631, 53512-10-0,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.048g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	161.16g/mol
Monoisotopic Mass	161.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	38.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number