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Home > Other Heterocycles > 1240525-73-8

1240525-73-8

1240525-73-8 | 3-benzyl-6-(4-methoxyphenyl)-3-azabicyclo[3.1.1]heptan-6-ol

CAS No: 1240525-73-8 Catalog No: AG019RBV MDL No:MFCD19442698

Product Description

Catalog Number:
AG019RBV
Chemical Name:
3-benzyl-6-(4-methoxyphenyl)-3-azabicyclo[3.1.1]heptan-6-ol
CAS Number:
1240525-73-8
Molecular Formula:
C20H23NO2
Molecular Weight:
309.4021
MDL Number:
MFCD19442698
IUPAC Name:
3-benzyl-6-(4-methoxyphenyl)-3-azabicyclo[3.1.1]heptan-6-ol
InChI:
InChI=1S/C20H23NO2/c1-23-19-9-7-16(8-10-19)20(22)17-11-18(20)14-21(13-17)12-15-5-3-2-4-6-15/h2-10,17-18,22H,11-14H2,1H3
InChI Key:
QYTFAGWHTOOKET-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1(O)C2CN(CC1C2)Cc1ccccc1

Properties

Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.173g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
309.409g/mol
Monoisotopic Mass:
309.173g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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