AG0028N8

20300-59-8 | 7-Methoxy-2-oxochromene-3-carboxylic acid

AG0028N8

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CAS Number	20300-59-8
Catalog Number	AG0028N8(AGN-PC-0JTALZ)
Chemical Name	7-Methoxy-2-oxochromene-3-carboxylic acid
IUPAC Name	7-methoxy-2-oxochromene-3-carboxylic acid
InChI	InChI=1S/C11H8O5/c1-15-7-3-2-6-4-8(10(12)13)11(14)16-9(6)5-7/h2-5H,1H3,(H,12,13)
InChI Key	VEEGNDSSWAOLFN-UHFFFAOYSA-N
MDL Number	MFCD00452770
Molecular Formula	C11H8O5
Molecular Weight	220.1782
SMILES	COC1=CC=C2C=C(C(O)=O)C(=O)OC2=C1
Synonyms	20300-59-8, 7-Methoxy-2-oxo-2H-chromene-3-carboxylic acid, 7-Methoxycoumarin-3-carboxylic acid, 7-methoxy-2-oxochromene-3-carboxylic acid, CHEMBL1830821, VEEGNDSSWAOLFN-UHFFFAOYSA-N, J-100198, 2H-1-Benzopyran-3-carboxylic acid, 7-methoxy-2-oxo-, CBDivE_003875, 7-METHOXYCOUMARIN-3-CARBOXYLICACID, AC1LBJRY, ACMC-1CCG3, AC1Q5T4D, 3-carboxy-7-methoxycoumarin, 7-methoxy-3-carboxycoumarin, Oprea1_241131, 7-methoxy-3-carboxy-coumarin, SCHEMBL203997, CTK1A1694, DTXSID30342708, 7-Methoxycoumarin-3-carbonic acid, ZINC187140, 0407AB, ANW-24012, BDBM50442714, MFCD00452770, SBB095931, STK387486, AKOS002230557, ACN-051031, AM84699, CCG-251868, Cumarin-3-carboxylic acid, 7-methoxy-, MCULE-8805935915, KS-00000Y49, AJ-17720, AK-86873, AX8110794, DB-026433, TC-112757, FT-0621448, M2233, ST50114632, 300M598, 7-Methoxy-2-oxo-2H-chromene-3-carboxylic acid #, SR-01000308907, 10X-0804, I04-9769, SR-01000308907-1, (S)-(-)-3,3-DIBROMO-1,1-BI-2-NAPHTHOL, 2H-1-Benzopyran-3-carboxylicacid, 7-methoxy-2-oxo-, 7-Methoxycoumarin-3-carboxylic acid, suitable for fluorescence, >=97.0% (HPCE), C11H8O5, AR-1H3653, CID583941, 20395-17-9,

Complexity	346
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.037g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	220.18g/mol
Monoisotopic Mass	220.037g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	72.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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

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