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Home > Other Heterocycles > 125834-96-0
125834-96-0 | 3-phenyl-9-azabicyclo[3.3.1]nonan-3-ol
CAS No: 125834-96-0 Catalog No: AG019R5D MDL No:MFCD13196438
Product Description
Catalog Number:
AG019R5D
Chemical Name:
3-phenyl-9-azabicyclo[3.3.1]nonan-3-ol
CAS Number:
125834-96-0
Molecular Formula:
C14H19NO
Molecular Weight:
217.3068
MDL Number:
MFCD13196438
IUPAC Name:
3-phenyl-9-azabicyclo[3.3.1]nonan-3-ol
InChI:
InChI=1S/C14H19NO/c16-14(11-5-2-1-3-6-11)9-12-7-4-8-13(10-14)15-12/h1-3,5-6,12-13,15-16H,4,7-10H2
InChI Key:
XZHGLQVLVUJNKI-UHFFFAOYSA-N
SMILES:
OC1(CC2CCCC(C1)N2)c1ccccc1
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:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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