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Home > Other Heterocycles > 1217977-97-3
1217977-97-3 | (1S,4S)-rel-2-Benzyl-2,5-Diaza-bicyclo[2.2.1]heptane
CAS No: 1217977-97-3 Catalog No: AG01DMQT MDL No:MFCD06411670
Product Description
Catalog Number:
AG01DMQT
Chemical Name:
(1S,4S)-rel-2-Benzyl-2,5-Diaza-bicyclo[2.2.1]heptane
CAS Number:
1217977-97-3
MDL Number:
MFCD06411670
IUPAC Name:
(1S,4S)-2-benzyl-2,5-diazabicyclo[2.2.1]heptane
InChI:
InChI=1S/C12H16N2/c1-2-4-10(5-3-1)8-14-9-11-6-12(14)7-13-11/h1-5,11-13H,6-9H2/t11-,12-/m0/s1
InChI Key:
JPRFUVVWNBBEDI-RYUDHWBXSA-N
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
188.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.274g/mol
Monoisotopic Mass:
188.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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