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(3R,3'S)-[3,3'-bioxolane]-2,2',5,5'-tetrone

(3R,3'S)-[3,3'-bioxolane]-2,2',5,5'-tetrone

CAS: 17309-39-6

Formula: C8H6O6

SMILES: O=C1C[C@@H]([C@H]2CC(=O)OC2=O)C(=O)O1

IUPAC: (3R,3'S)-[3,3'-bioxolane]-2,2',5,5'-tetrone

InChI: InChI=1S/C8H6O6/c9-5-1-3(7(11)13-5)4-2-6(10)14-8(4)12/h3-4H,1-2H2/t3-,4-/m0/s1

Composition: C (48.50%), H (3.05%), O (48.45%)

Molar Mass: 198.13

Atom Count: 20

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 198.016437913
Formal Charge 0
FSP3 0.5
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey OLQWMCSSZKNOLQ-ZXZARUISSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.81
Topological Polar Surface Area 86.74
Polarizability 16.03
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
96% <6 Days 17309-39-6 $69.00-$226.55$69.00$226.55
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