AG0036Z5

61363-56-2 | 2H-Pyran-3,5(4H,6H)-dione

AG0036Z5

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CAS Number	61363-56-2
Catalog Number	AG0036Z5(AGN-PC-0JM436)
Chemical Name	2H-Pyran-3,5(4H,6H)-dione
IUPAC Name	oxane-3,5-dione
InChI	InChI=1S/C5H6O3/c6-4-1-5(7)3-8-2-4/h1-3H2
InChI Key	SMIQVIXGQSMHKF-UHFFFAOYSA-N
MDL Number	MFCD09032525
Molecular Formula	C5H6O3
Molecular Weight	114.0993
NSC Number	293808
SMILES	O=C1COCC(=O)C1
Synonyms	2H-pyran-3,5(4H,6H)-dione, 61363-56-2, oxane-3,5-dione, PYRAN-3,5-DIONE, tetrahydropyran-3,5-dione, NSC293808, PubChem23922, AC1L6VX4, SCHEMBL1722236, CTK2F8320, DTXSID70315279, SMIQVIXGQSMHKF-UHFFFAOYSA-N, ZINC4622256, 2H-Pyran-3,5-(4H,6H)-dione, ANW-70632, MFCD09032525, AKOS006288857, ACN-043570, CS-W005641, GS-4553, NSC-293808, PB14653, RP19125, KS-000006W4, AJ-51762, AK-32470, SC-21917, AB0138328, DB-072944, ST2410216, TC-067951, 4CH-007654, FT-0656041, I14-5703, J-509564, CID325287, A8510,

Complexity	114
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	114.032g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	114.1g/mol
Monoisotopic Mass	114.032g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

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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