5-hydroxy-2-methyloxane-3,4-dione

5-hydroxy-2-methyloxane-3,4-dione

CAS: 28564-83-2

Formula: C6H8O4

SMILES: CC1OCC(O)C(=O)C1=O

IUPAC: 5-hydroxy-2-methyloxane-3,4-dione

InChI: InChI=1/C6H8O4/c1-3-5(8)6(9)4(7)2-10-3/h3-4,7H,2H2,1H3

Composition: C (50.00%), H (5.60%), O (44.40%)

Molar Mass: 144.126

Atom Count: 18

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	144.042258738
Formal Charge	0
FSP3	0.67
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	DBWZMUCCGLAOHO-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	31.97
Topological Polar Surface Area	63.6
Polarizability	12.67
Ring Count	1
Rotatable Bond Count	0

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