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oxalic acid; bis(tert-butyl 4,7-diazaspiro[2.5]octane-4-carboxylate)

oxalic acid; bis(tert-butyl 4,7-diazaspiro[2.5]octane-4-carboxylate)

CAS: 2173992-48-6

Formula: C24H42N4O8

SMILES: OC(=O)C(O)=O.CC(C)(C)OC(=O)N1CCNCC11CC1.CC(C)(C)OC(=O)N1CCNCC11CC1

IUPAC: oxalic acid; bis(tert-butyl 4,7-diazaspiro[2.5]octane-4-carboxylate)

InChI: InChI=1S/2C11H20N2O2.C2H2O4/c2*1-10(2,3)15-9(14)13-7-6-12-8-11(13)4-5-11;3-1(4)2(5)6/h2*12H,4-8H2,1-3H3;(H,3,4)(H,5,6)

Composition: C (56.01%), H (8.23%), N (10.89%), O (24.87%)

Molar Mass: 514.62

Atom Count: 78

Heavy Atom Count: 36

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 514.300264328
Formal Charge 0
FSP3 0.83
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey WKRFVQBWZMOMMH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 57.54
Topological Polar Surface Area 41.57
Polarizability 22.97
Ring Count 4
Rotatable Bond Count 5

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97% <5 Days 2173992-48-6 $25.22-$1,888.98$25.22$45.40$107.19$322.82$556.10$1,110.94$1,888.98
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