bis(tert-butoxy)cyclobut-3-ene-1,2-dione

bis(tert-butoxy)cyclobut-3-ene-1,2-dione

CAS: 66478-66-8

Formula: C12H18O4

SMILES: CC(C)(C)OC1=C(OC(C)(C)C)C(=O)C1=O

IUPAC: bis(tert-butoxy)cyclobut-3-ene-1,2-dione

InChI: InChI=1S/C12H18O4/c1-11(2,3)15-9-7(13)8(14)10(9)16-12(4,5)6/h1-6H3

Composition: C (63.70%), H (8.02%), O (28.28%)

Molar Mass: 226.272

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	226.12050906
Formal Charge	0
FSP3	0.67
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	GFBOYCVDBGFJFT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.91
Topological Polar Surface Area	52.6
Polarizability	23.42
Ring Count	1
Rotatable Bond Count	4

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