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1818847-34-5 | 1-Piperidinecarboxylic acid, 4-hydrazinyl-, 1,1-dimethylethyl ester, ethanedioate (2:1)
CAS No: 1818847-34-5 Catalog No: AG002364 MDL No:
Product Description
Catalog Number:
AG002364
Chemical Name:
1-Piperidinecarboxylic acid, 4-hydrazinyl-, 1,1-dimethylethyl ester, ethanedioate (2:1)
CAS Number:
1818847-34-5
Molecular Formula:
C22H44N6O8
Molecular Weight:
520.6202
IUPAC Name:
tert-butyl 4-hydrazinylpiperidine-1-carboxylate;oxalic acid
InChI:
InChI=1S/2C10H21N3O2.C2H2O4/c2*1-10(2,3)15-9(14)13-6-4-8(12-11)5-7-13;3-1(4)2(5)6/h2*8,12H,4-7,11H2,1-3H3;(H,3,4)(H,5,6)
InChI Key:
MFCDHXAVWHSLHW-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)O.NNC1CCN(CC1)C(=O)OC(C)(C)C.NNC1CCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
520.322g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
520.628g/mol
Monoisotopic Mass:
520.322g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
210A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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