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Home > Other Heterocycles > 27574-20-5
27574-20-5 | 8-Azoniabicyclo[3.2.1]octane, 3-(5H-dibenzo[a,d]cyclohepten-5-ylidene)-8,8-dimethyl-, methyl sulfate (1:1)
CAS No: 27574-20-5 Catalog No: AG002U3D MDL No:
Product Description
Catalog Number:
AG002U3D
Chemical Name:
8-Azoniabicyclo[3.2.1]octane, 3-(5H-dibenzo[a,d]cyclohepten-5-ylidene)-8,8-dimethyl-, methyl sulfate (1:1)
CAS Number:
27574-20-5
IUPAC Name:
8,8-dimethyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)-8-azoniabicyclo[3.2.1]octane;methyl sulfate
InChI:
InChI=1S/C24H26N.CH4O4S/c1-25(2)20-13-14-21(25)16-19(15-20)24-22-9-5-3-7-17(22)11-12-18-8-4-6-10-23(18)24;1-5-6(2,3)4/h3-12,20-21H,13-16H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
InChI Key:
YLRSPFWCPMRUDA-UHFFFAOYSA-M
Properties
Complexity:
628
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
439.182g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
439.57g/mol
Monoisotopic Mass:
439.182g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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