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4,7,10,17,20,23-hexaoxa-13,14-dithiahexacosanedioic acid

4,7,10,17,20,23-hexaoxa-13,14-dithiahexacosanedioic acid

CAS: 2055014-98-5

Formula: C18H34O10S2

SMILES: OC(=O)CCOCCOCCOCCSSCCOCCOCCOCCC(O)=O

IUPAC: 4,7,10,17,20,23-hexaoxa-13,14-dithiahexacosanedioic acid

InChI: InChI=1S/C18H34O10S2/c19-17(20)1-3-23-5-7-25-9-11-27-13-15-29-30-16-14-28-12-10-26-8-6-24-4-2-18(21)22/h1-16H2,(H,19,20)(H,21,22)

Composition: C (45.56%), H (7.22%), O (33.71%), S (13.51%)

Molar Mass: 474.58

Atom Count: 64

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 474.159339643
Formal Charge 0
FSP3 0.89
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 10
Hydrogen Bond Donor Count 2
InChIKey DLBWMEFQLZTRTD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 115.14
Topological Polar Surface Area 129.98
Polarizability 45.47
Ring Count 0
Rotatable Bond Count 25

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 2055014-98-5 $510.30-$1,204.88$510.30$803.25$1,204.88
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