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Home > Other Heterocycles > 88550-35-0
88550-35-0 | 2-Azabicyclo[3.3.1]nonane, 5-(3-methoxyphenyl)-2-methyl-9-methylene-
CAS No: 88550-35-0 Catalog No: AG004DOH MDL No:
Product Description
Catalog Number:
AG004DOH
Chemical Name:
2-Azabicyclo[3.3.1]nonane, 5-(3-methoxyphenyl)-2-methyl-9-methylene-
CAS Number:
88550-35-0
Molecular Formula:
C17H23NO
Molecular Weight:
257.3706
IUPAC Name:
5-(3-methoxyphenyl)-2-methyl-9-methylidene-2-azabicyclo[3.3.1]nonane
InChI:
InChI=1S/C17H23NO/c1-13-16-8-5-9-17(13,10-11-18(16)2)14-6-4-7-15(12-14)19-3/h4,6-7,12,16H,1,5,8-11H2,2-3H3
InChI Key:
XTYQKGSWRGUDQE-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C12CCCC(C2=C)N(CC1)C
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.178g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.377g/mol
Monoisotopic Mass:
257.178g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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