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Home > Pyridines > 1215641-44-3
1215641-44-3 | 6-Benzyl-1-tert-boc-octahydropyrrolo[3,4-b]pyridine-d4
CAS No: 1215641-44-3 Catalog No: AG01E05S MDL No:
Product Description
Catalog Number:
AG01E05S
Chemical Name:
6-Benzyl-1-tert-boc-octahydropyrrolo[3,4-b]pyridine-d4
CAS Number:
1215641-44-3
IUPAC Name:
tert-butyl 6-benzyl-5,5,7,7-tetradeuterio-3,4,4a,7a-tetrahydro-2H-pyrrolo[3,4-b]pyridine-1-carboxylate
InChI:
InChI=1S/C19H28N2O2/c1-19(2,3)23-18(22)21-11-7-10-16-13-20(14-17(16)21)12-15-8-5-4-6-9-15/h4-6,8-9,16-17H,7,10-14H2,1-3H3/i13D2,14D2
InChI Key:
IWDFFHIOVOXFOW-RYIWKTDQSA-N
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.24g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
4
Molecular Weight:
320.469g/mol
Monoisotopic Mass:
320.24g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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