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bis((4-aminooxan-2-yl)methanol); oxalic acid

bis((4-aminooxan-2-yl)methanol); oxalic acid

CAS: 2411635-70-4

Formula: C14H28N2O8

SMILES: OC(=O)C(O)=O.NC1CCOC(CO)C1.NC1CCOC(CO)C1

IUPAC: bis((4-aminooxan-2-yl)methanol); oxalic acid

InChI: InChI=1/2C6H13NO2.C2H2O4/c2*7-5-1-2-9-6(3-5)4-8;3-1(4)2(5)6/h2*5-6,8H,1-4,7H2;(H,3,4)(H,5,6)

Composition: C (47.72%), H (8.01%), N (7.95%), O (36.32%)

Molar Mass: 352.384

Atom Count: 52

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 4
Exact Mass 352.18456587
Formal Charge 0
FSP3 0.86
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey PSSYSUZDZHSDJA-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.36
Topological Polar Surface Area 55.48
Polarizability 13.91
Ring Count 2
Rotatable Bond Count 3

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