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tert-butyl 3-(2-{[2-(oxan-2-yloxy)ethyl]disulfanyl}ethoxy)propanoate

tert-butyl 3-(2-{[2-(oxan-2-yloxy)ethyl]disulfanyl}ethoxy)propanoate

CAS: 1807503-88-3

Formula: C16H30O5S2

SMILES: CC(C)(C)OC(=O)CCOCCSSCCOC1CCCCO1

IUPAC: tert-butyl 3-(2-{[2-(oxan-2-yloxy)ethyl]disulfanyl}ethoxy)propanoate

InChI: InChI=1/C16H30O5S2/c1-16(2,3)21-14(17)7-9-18-10-12-22-23-13-11-20-15-6-4-5-8-19-15/h15H,4-13H2,1-3H3

Composition: C (52.43%), H (8.25%), O (21.82%), S (17.49%)

Molar Mass: 366.53

Atom Count: 53

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 366.153466414
Formal Charge 0
FSP3 0.94
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey JTKJXQXCOWSQCZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 96.79
Topological Polar Surface Area 53.99
Polarizability 38.51
Ring Count 1
Rotatable Bond Count 13

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1807503-88-3 $245.70-$529.20$245.70$425.25$529.20
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