1,4-dioxocane-5,8-dione

1,4-dioxocane-5,8-dione

CAS: 21962-84-5

Formula: C6H8O4

SMILES: O=C1CCC(=O)OCCO1

IUPAC: 1,4-dioxocane-5,8-dione

InChI: InChI=1S/C6H8O4/c7-5-1-2-6(8)10-4-3-9-5/h1-4H2

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	0
Exact Mass	144.042258738
Formal Charge	0
FSP3	0.67
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	LOWXIIGCOBSYKX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	31.11
Topological Polar Surface Area	52.6
Polarizability	12.74
Ring Count	1
Rotatable Bond Count	0

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