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bis(2,2-dimethyl-1-(piperazin-1-yl)propan-1-one); oxalic acid

bis(2,2-dimethyl-1-(piperazin-1-yl)propan-1-one); oxalic acid

CAS: 155295-47-9

Formula: C20H38N4O6

SMILES: OC(=O)C(O)=O.CC(C)(C)C(=O)N1CCNCC1.CC(C)(C)C(=O)N1CCNCC1

IUPAC: bis(2,2-dimethyl-1-(piperazin-1-yl)propan-1-one); oxalic acid

InChI: InChI=1S/2C9H18N2O.C2H2O4/c2*1-9(2,3)8(12)11-6-4-10-5-7-11;3-1(4)2(5)6/h2*10H,4-7H2,1-3H3;(H,3,4)(H,5,6)

Composition: C (55.79%), H (8.90%), N (13.01%), O (22.30%)

Molar Mass: 430.546

Atom Count: 68

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 430.27913496
Formal Charge 0
FSP3 0.8
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey BRFZELBGLXGRRL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.72
Topological Polar Surface Area 32.34
Polarizability 19.31
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 155295-47-9 $212.75-$603.75$212.75$385.25$603.75
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