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4,7,10,13,19,22,25,28-octaoxa-16-thiahentriaconta-1,30-diyne

4,7,10,13,19,22,25,28-octaoxa-16-thiahentriaconta-1,30-diyne

CAS: 2055041-17-1

Formula: C22H38O8S

SMILES: C#CCOCCOCCOCCOCCSCCOCCOCCOCCOCC#C

IUPAC: 4,7,10,13,19,22,25,28-octaoxa-16-thiahentriaconta-1,30-diyne

InChI: InChI=1S/C22H38O8S/c1-3-5-23-7-9-25-11-13-27-15-17-29-19-21-31-22-20-30-18-16-28-14-12-26-10-8-24-6-4-2/h1-2H,5-22H2

Composition: C (57.12%), H (8.28%), O (27.67%), S (6.93%)

Molar Mass: 462.6

Atom Count: 69

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 462.228739358
Formal Charge 0
FSP3 0.82
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 0
InChIKey FWWYVRGWJPDTIG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 122.81
Topological Polar Surface Area 73.84
Polarizability 47.73
Ring Count 0
Rotatable Bond Count 26

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 2055041-17-1 $264.60-$1,181.25$264.60$425.25$642.60$1,181.25
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