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(2R,3R,5R)-5-(benzoyloxy)-2-[(benzoyloxy)methyl]-4-oxooxolan-3-yl benzoate

(2R,3R,5R)-5-(benzoyloxy)-2-[(benzoyloxy)methyl]-4-oxooxolan-3-yl benzoate

CAS: 157037-56-4

Formula: C26H20O8

SMILES: O=C(OC[C@H]1O[C@H](OC(=O)C2=CC=CC=C2)C(=O)[C@@H]1OC(=O)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: (2R,3R,5R)-5-(benzoyloxy)-2-[(benzoyloxy)methyl]-4-oxooxolan-3-yl benzoate

InChI: InChI=1S/C26H20O8/c27-21-22(33-24(29)18-12-6-2-7-13-18)20(16-31-23(28)17-10-4-1-5-11-17)32-26(21)34-25(30)19-14-8-3-9-15-19/h1-15,20,22,26H,16H2/t20-,22-,26-/m1/s1

Composition: C (67.82%), H (4.38%), O (27.80%)

Molar Mass: 460.438

Atom Count: 54

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 3
Exact Mass 460.115817604
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey XNTDXEVKPQUSSA-RQNQAMLKSA-N
Lipinski's Rule of Five
Molar Refractivity 118.75
Topological Polar Surface Area 105.2
Polarizability 46.54
Ring Count 4
Rotatable Bond Count 10

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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 157037-56-4 $2,303.91-$5,557.95$2,303.91$5,557.95
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Purity LeadTime CAS PacketSize UnitPrice
% <6 Days 157037-56-4 $2,333.35-$5,701.70$2,333.35$5,701.70
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