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O-[9-(2-{2-[2-(prop-2-yn-1-yloxy)ethoxy]ethoxy}ethyl)-3,6,12,15,18-pentaoxa-9-azahenicos-20-yn-1-yl]hydroxylamine

O-[9-(2-{2-[2-(prop-2-yn-1-yloxy)ethoxy]ethoxy}ethyl)-3,6,12,15,18-pentaoxa-9-azahenicos-20-yn-1-yl]hydroxylamine

CAS: 2112737-71-8

Formula: C24H44N2O9

SMILES: NOCCOCCOCCN(CCOCCOCCOCC#C)CCOCCOCCOCC#C

IUPAC: O-[9-(2-{2-[2-(prop-2-yn-1-yloxy)ethoxy]ethoxy}ethyl)-3,6,12,15,18-pentaoxa-9-azahenicos-20-yn-1-yl]hydroxylamine

InChI: InChI=1S/C24H44N2O9/c1-3-8-27-13-18-32-20-15-29-10-5-26(7-12-31-17-22-34-23-24-35-25)6-11-30-16-21-33-19-14-28-9-4-2/h1-2H,5-25H2

Composition: C (57.12%), H (8.79%), N (5.55%), O (28.53%)

Molar Mass: 504.621

Atom Count: 79

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 504.304681005
Formal Charge 0
FSP3 0.83
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 11
Hydrogen Bond Donor Count 1
InChIKey WGCOEHNJZCCDJL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 133.86
Topological Polar Surface Area 112.33
Polarizability 52.11
Ring Count 0
Rotatable Bond Count 29

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 2112737-71-8 $330.75-$1,039.50$330.75$642.60$1,039.50
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