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50559-66-5 | 3,3'-(1a,2,7,7a-Tetrahydro-1,2,7-metheno-1H-cyclopropa[b]naphthalene-1,8-diyl)bispyridine
CAS No: 50559-66-5 Catalog No: AG00DM61 MDL No:
Product Description
Catalog Number:
AG00DM61
Chemical Name:
3,3'-(1a,2,7,7a-Tetrahydro-1,2,7-metheno-1H-cyclopropa[b]naphthalene-1,8-diyl)bispyridine
CAS Number:
50559-66-5
IUPAC Name:
3-(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/C22H16N2/c1-2-8-16-15(7-1)17-19-20-18(16)21(17,13-5-3-9-23-11-13)22(19,20)14-6-4-10-24-12-14/h1-12,17-20H
InChI Key:
VCVCGQSZIBMEKU-UHFFFAOYSA-N
Properties
Complexity:
544
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.131g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.384g/mol
Monoisotopic Mass:
308.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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