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Home > Other Heterocycles > 112348-23-9
112348-23-9 | 9-Azabicyclo[4.2.1]nonan-2-ol, 9-(phenylmethyl)-
CAS No: 112348-23-9 Catalog No: AG007BAP MDL No:
Product Description
Catalog Number:
AG007BAP
Chemical Name:
9-Azabicyclo[4.2.1]nonan-2-ol, 9-(phenylmethyl)-
CAS Number:
112348-23-9
Molecular Formula:
C15H21NO
Molecular Weight:
231.3333
IUPAC Name:
9-benzyl-9-azabicyclo[4.2.1]nonan-2-ol
InChI:
InChI=1S/C15H21NO/c17-15-8-4-7-13-9-10-14(15)16(13)11-12-5-2-1-3-6-12/h1-3,5-6,13-15,17H,4,7-11H2
InChI Key:
JDJKUFNMNADBIL-UHFFFAOYSA-N
SMILES:
OC1CCCC2N(C1CC2)Cc1ccccc1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.162g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.339g/mol
Monoisotopic Mass:
231.162g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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