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50559-68-7 | 3,3'-(1a,2,7,7a-Tetrahydro-2-methoxy-1,2,7-metheno-1H-cyclopropa[b]naphthalene-1,8-diyl)bispyridine
CAS No: 50559-68-7 Catalog No: AG00DM62 MDL No:
Product Description
Catalog Number:
AG00DM62
Chemical Name:
3,3'-(1a,2,7,7a-Tetrahydro-2-methoxy-1,2,7-metheno-1H-cyclopropa[b]naphthalene-1,8-diyl)bispyridine
CAS Number:
50559-68-7
IUPAC Name:
3-(2-methoxy-3-pyridin-3-yl-4-pentacyclo[6.4.0.02,5.03,7.04,6]dodeca-1(12),8,10-trienyl)pyridine
InChI:
InChI=1S/C23H18N2O/c1-26-23-17-9-3-2-8-16(17)18-19-20(23)21(19,14-6-4-10-24-12-14)22(18,23)15-7-5-11-25-13-15/h2-13,18-20H,1H3
InChI Key:
JKSWOAADDJGEQL-UHFFFAOYSA-N
Properties
Complexity:
638
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.142g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.41g/mol
Monoisotopic Mass:
338.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
6
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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