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1,25-di-tert-butyl 13-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)-4,7,10,16,19,22-hexaoxa-13-azapentacosanedioate

1,25-di-tert-butyl 13-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)-4,7,10,16,19,22-hexaoxa-13-azapentacosanedioate

CAS: 2055042-56-1

Formula: C34H66N4O13

SMILES: CC(C)(C)OC(=O)CCOCCOCCOCCN(CCOCCOCCOCCN=[N+]=[N-])CCOCCOCCOCCC(=O)OC(C)(C)C

IUPAC: 1,25-di-tert-butyl 13-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)-4,7,10,16,19,22-hexaoxa-13-azapentacosanedioate

InChI: InChI=1S/C34H66N4O13/c1-33(2,3)50-31(39)7-13-41-19-25-47-28-22-44-16-10-38(12-18-46-24-30-49-27-21-43-15-9-36-37-35)11-17-45-23-29-48-26-20-42-14-8-32(40)51-34(4,5)6/h7-30H2,1-6H3

Composition: C (55.27%), H (9.00%), N (7.58%), O (28.15%)

Molar Mass: 738.917

Atom Count: 117

Heavy Atom Count: 51

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 738.462638201
Formal Charge 0
FSP3 0.94
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 14
Hydrogen Bond Donor Count 0
InChIKey GZZBWIKELRCXSD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 190.68
Topological Polar Surface Area 168.34
Polarizability 75.09
Ring Count 0
Rotatable Bond Count 40

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 2055042-56-1 $302.40-$926.10$302.40$548.10$926.10
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