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1301706-56-8 | (2S)-2-(Aminomethyl)-4,4-diethoxypiperidine fumarate, 2-BOC protected
CAS No: 1301706-56-8 Catalog No: AG01FL5N MDL No:
Product Description
Catalog Number:
AG01FL5N
Chemical Name:
(2S)-2-(Aminomethyl)-4,4-diethoxypiperidine fumarate, 2-BOC protected
CAS Number:
1301706-56-8
IUPAC Name:
(E)-but-2-enedioic acid;tert-butyl N-[[(2S)-4,4-diethoxypiperidin-2-yl]methyl]carbamate
InChI:
InChI=1S/C15H30N2O4.C4H4O4/c1-6-19-15(20-7-2)8-9-16-12(10-15)11-17-13(18)21-14(3,4)5;5-3(6)1-2-4(7)8/h12,16H,6-11H2,1-5H3,(H,17,18);1-2H,(H,5,6)(H,7,8)/b;2-1+/t12-;/m0./s1
InChI Key:
HCNKZGJFFYKTGU-GYDOPSIJSA-N
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Exact Mass:
418.232g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
418.487g/mol
Monoisotopic Mass:
418.232g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
143A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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