AG01DDPO

91344-89-7 | Methyl 4-oxo-3,4-dihydro-2H-chroMene-8-carboxylate

AG01DDPO

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CAS Number	91344-89-7
Catalog Number	AG01DDPO
Chemical Name	Methyl 4-oxo-3,4-dihydro-2H-chroMene-8-carboxylate
IUPAC Name	methyl 4-oxo-2,3-dihydrochromene-8-carboxylate
InChI	InChI=1S/C11H10O4/c1-14-11(13)8-4-2-3-7-9(12)5-6-15-10(7)8/h2-4H,5-6H2,1H3
InChI Key	AUPXCMMROYOPBY-UHFFFAOYSA-N
MDL Number	MFCD18648381
Molecular Formula	C11H10O4
Molecular Weight	206.1947
SMILES	O=C1CCOC2=C(C=CC=C12)C(=O)OC
Synonyms	Methyl 4-oxochroman-8-carboxylate, 91344-89-7, methyl 4-oxo-3,4-dihydro-2H-chromene-8-carboxylate, AMOT0870, SCHEMBL19973891, Methyl 4-oxochromane-8-carboxylate, MFCD18648381, AK686271, DS-20143, methyl 4-oxo-2,3-dihydrochromene-8-carboxylate, ACN-041084,

Complexity	274
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.058g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	206.197g/mol
Monoisotopic Mass	206.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

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

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