AG005MKO

77423-14-4 | 2,4-Dioxo-2,4-dihydro-1H-benzo[d][1,3]oxazine-7-carboxylic acid

AG005MKO

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CAS Number	77423-14-4
Catalog Number	AG005MKO(AGN-PC-0KKLQ0)
Chemical Name	2,4-Dioxo-2,4-dihydro-1H-benzo[d][1,3]oxazine-7-carboxylic acid
IUPAC Name	2,4-dioxo-1H-3,1-benzoxazine-7-carboxylic acid
InChI	InChI=1S/C9H5NO5/c11-7(12)4-1-2-5-6(3-4)10-9(14)15-8(5)13/h1-3H,(H,10,14)(H,11,12)
InChI Key	LSXSNVAJTUIEHR-UHFFFAOYSA-N
MDL Number	MFCD00798181
Molecular Formula	C9H5NO5
Molecular Weight	207.1397
SMILES	OC(=O)C1=CC2=C(C=C1)C(=O)OC(=O)N2
Synonyms	77423-14-4, 4-Carboxylic-isatoic anhydride, 4-carboxylicisatoic anhydride, 2,4-dioxo-2,4-dihydro-1h-benzo[d][1,3]oxazine-7-carboxylic acid, 4-carboxylic isatoic anhydride, 2,4-dioxo-1H-3,1-benzoxazine-7-carboxylic acid, Q-102089, 2H-3,1-Benzoxazine-7-carboxylicacid, 1,4-dihydro-2,4-dioxo-, isatoic anhydride-4-carboxylic acid, AC1MBVPZ, PubChem15881, 4-Carboxylicisatoicanhydride, SCHEMBL2383357, CTK2H6970, DTXSID00373862, CS-D0291, ZINC2569651, 2134AC, ANW-54406, MFCD00798181, AKOS015856055, VZ28663, AJ-41749, AK-94883, AS-38674, 4-carboxylic-isatoic anhydride, AldrichCPR, AB0078036, AX8011477, FT-0641647, X-1837, A839093, S14-2345, 2,4-bis(oxidanylidene)-1H-3,1-benzoxazine-7-carboxylic acid, 2,4-dioxo-2,4-dihydro-1H-3,1-benzoxazine-7-carboxylic acid, 2,4-dioxo-1,4-dihydro-2h-benzo[d][1,3]oxazine-7-carboxylic acid, 2H-3,1-Benzoxazine-7-carboxylic acid, 1,4-dihydro-2,4-dioxo-, C9H5NO5, cc-695, 4-CARBOXYLIC-ISATOICANHYDRIDE, CID2757375, 2,4-Dioxo-2,4-dihydro-1H-benzo[d][1,3]oxazine-7-carboxylicacid, 7,9-dioxo-8-oxa-10-azabicyclo[4.4.0]deca-2,4,11-triene-3-carboxylic Acid,

Complexity	327
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.017g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	207.141g/mol
Monoisotopic Mass	207.017g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	92.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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