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42315-58-2 | 6,9-Methano-2H-azepino[1,2-a]benzimidazole(9CI)
CAS No: 42315-58-2 Catalog No: AG00D7C1 MDL No:
Product Description
Catalog Number:
AG00D7C1
Chemical Name:
6,9-Methano-2H-azepino[1,2-a]benzimidazole(9CI)
CAS Number:
42315-58-2
IUPAC Name:
3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-1,3,5,8,11,13-hexaene
InChI:
InChI=1S/C13H10N2/c1-2-4-12-11(3-1)14-13-10-6-5-9(7-10)8-15(12)13/h1,3-6,8H,2,7H2
InChI Key:
KIQNFAORYZMICU-UHFFFAOYSA-N
Properties
Complexity:
539
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.237g/mol
Monoisotopic Mass:
194.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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