AG001MT5

15071-04-2 | 6H-1,3-Dioxolo[4,5-g][1]benzopyran-6-one, 8-methyl-

AG001MT5

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CAS Number	15071-04-2
Catalog Number	AG001MT5(AGN-PC-0JTQFH)
Chemical Name	6H-1,3-Dioxolo[4,5-g][1]benzopyran-6-one, 8-methyl-
IUPAC Name	8-methyl-[1,3]dioxolo[4,5-g]chromen-6-one
InChI	InChI=1S/C11H8O4/c1-6-2-11(12)15-8-4-10-9(3-7(6)8)13-5-14-10/h2-4H,5H2,1H3
InChI Key	XAOGHIKJQRXPHX-UHFFFAOYSA-N
MDL Number	MFCD00143343
Molecular Formula	C11H8O4
Molecular Weight	204.1788
SMILES	O=C1OC2=C(C=C(OCO3)C3=C2)C(C)=C1
Synonyms	4-Methyl-6,7-methylenedioxycoumarin, 15071-04-2, 4-Methylayapin, 8-methyl-[1,3]dioxolo[4,5-g]chromen-6-one, 8-Methyl-6H-[1,3]dioxolo[4,5-g]chromen-6-one, AC1LCZ9S, ACMC-1C9GT, Oprea1_675013, MLS001164725, CHEMBL1592675, CTK4C6743, DTXSID50346066, XAOGHIKJQRXPHX-UHFFFAOYSA-N, HMS2876M20, ZINC187077, ANW-21296, MFCD00143343, AKOS003620980, MCULE-4614703888, SMR000539918, ZB009406, TC-110041, FT-0725117, M0971, C-56353, SR-01000195988, J-008732, SR-01000195988-1, 8-Methyl-6H-[1,3]dioxolo[4,5-g]chromen-6-one #, 6H-1,3-Dioxolo[4,5-g][1]benzopyran-6-one,8-methyl-, CID609315, ZINC00187077,

Complexity	323
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.042g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	204.181g/mol
Monoisotopic Mass	204.042g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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