5-Boc-octahydro-pyrrolo[3,2-b]pyridine


Chemical Name: 5-Boc-octahydro-pyrrolo[3,2-b]pyridine
CAS Number: 1277168-52-1
Product Number: AG000XC5(AGN-PC-0WAB1P)
Synonyms:
MDL No:
Molecular Formula: C12H22N2O2
Molecular Weight: 226.3153

Identification/Properties


Computed Properties
Molecular Weight:
226.32g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
226.168g/mol
Monoisotopic Mass:
226.168g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
273
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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