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Home > Other Heterocycles > 138660-53-4
138660-53-4 | 3-benzyl-8-azabicyclo[3.2.1]octan-3-ol
CAS No: 138660-53-4 Catalog No: AG01BCF1 MDL No:MFCD18368730
Product Description
Catalog Number:
AG01BCF1
Chemical Name:
3-benzyl-8-azabicyclo[3.2.1]octan-3-ol
CAS Number:
138660-53-4
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
MDL Number:
MFCD18368730
IUPAC Name:
3-benzyl-8-azabicyclo[3.2.1]octan-3-ol
InChI:
InChI=1S/C14H19NO/c16-14(8-11-4-2-1-3-5-11)9-12-6-7-13(10-14)15-12/h1-5,12-13,15-16H,6-10H2
InChI Key:
RSSJZKTVBGLHTH-UHFFFAOYSA-N
SMILES:
OC1(CC2CCC(C1)N2)Cc1ccccc1
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.312g/mol
Monoisotopic Mass:
217.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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