AG001HVI

142166-00-5 | Methyl 3-oxo-2,4-dihydro-1,4-benzoxazine-7-carboxylate

AG001HVI

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CAS Number	142166-00-5
Catalog Number	AG001HVI(AGN-PC-0NBJOF)
Chemical Name	Methyl 3-oxo-2,4-dihydro-1,4-benzoxazine-7-carboxylate
IUPAC Name	methyl 3-oxo-4H-1,4-benzoxazine-7-carboxylate
InChI	InChI=1S/C10H9NO4/c1-14-10(13)6-2-3-7-8(4-6)15-5-9(12)11-7/h2-4H,5H2,1H3,(H,11,12)
InChI Key	HBGXBRNLTSFTIG-UHFFFAOYSA-N
MDL Number	MFCD07774184
Molecular Formula	C10H9NO4
Molecular Weight	207.1828
SMILES	COC(=O)C1=CC=C2NC(=O)COC2=C1
Synonyms	142166-00-5, methyl 3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carboxylate, methyl 3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-carboxylate, Methyl 3-oxo-2,4-dihydro-1,4-benzoxazine-7-carboxylate, 2H-1,4-BENZOXAZINE-7-CARBOXYLIC ACID, 3,4-DIHYDRO-3-OXO-, METHYL ESTER, PubChem20118, ACMC-1BZU5, Methyl 3-oxo-4H-1,4-benzoxazine-7-carboxylate, SCHEMBL303909, CTK4C2975, DTXSID20445712, HBGXBRNLTSFTIG-UHFFFAOYSA-N, ALBB-010265, KS-00000BU2, ANW-20678, MFCD07774184, SBB050291, STK895066, ZINC22995846, AKOS005072612, CS-W000707, GC-0720, MB04718, MCULE-1790890224, RP12061, RTR-005406, TRA0078749, AJ-81552, AM803208, CJ-17390, ST092952, SY028206, AB0058553, DB-063422, FT-0681011, V3172, C-4433, MFCD07774184 (95+%), J-522205, I01-15975, methyl 3-oxo-2H,4H-benzo[e]1,4-oxazine-7-carboxylate, 7-methoxycarbonyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine, Methyl3-Oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carboxylate, methyl 3-oxo-2H,4H-benzo[e]1,4-oxazaperhydroine-7-carboxylate, methyl 3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7- carboxylate, 2H-1,4-Benzoxazine-7-carboxylicacid, 3,4-dihydro-3-oxo-, methyl ester, 3-Oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carboxylic acid methyl ester, 3-Oxo-3,4-dihydro-2H-benzo[1,4]oxazine-7-carboxylic acid methyl ester, C10H9NO4, CID10845978, Methyl3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-carboxylate, Methyl 9-oxo-7-oxa-10-azabicyclo[4.4.0]deca-2,4,11-triene-4-carboxylate,

Complexity	279
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.053g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	207.185g/mol
Monoisotopic Mass	207.053g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	64.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P264-P270-P301+P312-P330
UN Code

Certificate of Analysis

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