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Home > Other Heterocycles > 1312555-06-8
1312555-06-8 | 6-benzyl-3,6-diazabicyclo[3.1.1]heptane
CAS No: 1312555-06-8 Catalog No: AG01DY5R MDL No:
Product Description
Catalog Number:
AG01DY5R
Chemical Name:
6-benzyl-3,6-diazabicyclo[3.1.1]heptane
CAS Number:
1312555-06-8
IUPAC Name:
6-benzyl-3,6-diazabicyclo[3.1.1]heptane
InChI:
InChI=1S/C12H16N2/c1-2-4-10(5-3-1)9-14-11-6-12(14)8-13-7-11/h1-5,11-13H,6-9H2
InChI Key:
AZSUQFVNLCDVAW-UHFFFAOYSA-N
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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