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tert-butyl 1-(methanesulfonyloxy)-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacontan-39-oate

tert-butyl 1-(methanesulfonyloxy)-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacontan-39-oate

CAS: 2097604-01-6

Formula: C32H64O17S

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

IUPAC: tert-butyl 1-(methanesulfonyloxy)-3,6,9,12,15,18,21,24,27,30,33,36-dodecaoxanonatriacontan-39-oate

InChI: InChI=1S/C32H64O17S/c1-32(2,3)49-31(33)5-6-36-7-8-37-9-10-38-11-12-39-13-14-40-15-16-41-17-18-42-19-20-43-21-22-44-23-24-45-25-26-46-27-28-47-29-30-48-50(4,34)35/h5-30H2,1-4H3

Composition: C (51.05%), H (8.57%), O (36.12%), S (4.26%)

Molar Mass: 752.91

Atom Count: 114

Heavy Atom Count: 50

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 752.386421775
Formal Charge 0
FSP3 0.97
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 15
Hydrogen Bond Donor Count 0
InChIKey LJIIDUPJCGAFRW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 182.89
Topological Polar Surface Area 180.43
Polarizability 73.94
Ring Count 0
Rotatable Bond Count 42

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 2097604-01-6 $340.20-$841.05$340.20$529.20$841.05
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