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[(2R,3S,5R)-5-chloro-3-(4-chlorobenzoyloxy)oxolan-2-yl]methyl 4-chlorobenzoate

[(2R,3S,5R)-5-chloro-3-(4-chlorobenzoyloxy)oxolan-2-yl]methyl 4-chlorobenzoate

CAS: 21740-23-8

Formula: C19H15Cl3O5

SMILES: Cl[C@@H]1C[C@H](OC(=O)C2=CC=C(Cl)C=C2)[C@@H](COC(=O)C2=CC=C(Cl)C=C2)O1

IUPAC: [(2R,3S,5R)-5-chloro-3-(4-chlorobenzoyloxy)oxolan-2-yl]methyl 4-chlorobenzoate

InChI: InChI=1S/C19H15Cl3O5/c20-13-5-1-11(2-6-13)18(23)25-10-16-15(9-17(22)26-16)27-19(24)12-3-7-14(21)8-4-12/h1-8,15-17H,9-10H2/t15-,16+,17-/m0/s1

Composition: C (53.11%), H (3.52%), Cl (24.75%), O (18.62%)

Molar Mass: 429.67

Atom Count: 42

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 3
Exact Mass 427.9985067
Formal Charge 0
FSP3 0.26
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey QEHCZULNFYDPPL-BBWFWOEESA-N
Lipinski's Rule of Five
Molar Refractivity 101.24
Topological Polar Surface Area 61.83
Polarizability 39.99
Ring Count 3
Rotatable Bond Count 7

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Purity LeadTime CAS PacketSize UnitPrice
98.88% <7 Days 21740-23-8 $69.19-$647.96$69.19$139.32$647.96
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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 21740-23-8 $36.57-$221.94$36.57$221.94
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