SnAP 3-Spiro-(2-Pyr) M Reagent

Product Information

Molecular Formula:
C23H48N2O3Sn
Molecular Weight:
519.35
Description
SnAP Reagents provide a one-step route, in tandem with various aldehyde substrates, to saturated N-heterocycles. The synthesis of N-heterocycles through SnAP Reagents requires mild reaction conditions, and aldehydes bearing aryl, heteroaryl, glyoxyl, aliphatic, and halogenated groups are well tolerated. This product was introduced in collaboration with the Bode Research Group
Synonyms
TERT-BUTYL 3-AMINO-3-{[(TRIBUTYLSTANNYL)METHOXY]METHYL}PYRROLIDINE-1-CARBOXYLATE
IUPAC Name
tert-butyl 3-amino-3-(tributylstannylmethoxymethyl)pyrrolidine-1-carboxylate
Canonical SMILES
CCCC[Sn](CCCC)(CCCC)COCC1(CCN(C1)C(=O)OC(C)(C)C)N
InChI
InChI=1S/C11H21N2O3.3C4H9.Sn/c1-10(2,3)16-9(14)13-6-5-11(12,7-13)8-15-43*1-3-4-2/h4-8,12H2,1-3H33*1,3-4H2,2H3
InChI Key
JLZWEXDNLRNRBE-UHFFFAOYSA-N
Density
1.122
Storage
−20°C
Refractive Index
n/D 1.489

Safety Information

Hazards
H301 - H315 - H319 - H335
Precautionary Statement
P301 + P310 + P330 - P302 + P352 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
15
Exact Mass
520.268696 g/mol
Monoisotopic Mass
520.268696 g/mol
Topological Polar Surface Area
64.8Ų
Heavy Atom Count
29
Formal Charge
0
Complexity
460
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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