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66596-62-1 | Imidazo[4,5,1-jk][1,4]benzodiazepine, 4,5,6,7-tetrahydro-2-methyl- (9CI)
CAS No: 66596-62-1 Catalog No: AG00FF3C MDL No:
Product Description
Catalog Number:
AG00FF3C
Chemical Name:
Imidazo[4,5,1-jk][1,4]benzodiazepine, 4,5,6,7-tetrahydro-2-methyl- (9CI)
CAS Number:
66596-62-1
IUPAC Name:
2-methyl-1,3,10-triazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraene
InChI:
InChI=1S/C11H13N3/c1-8-13-10-4-2-3-9-7-12-5-6-14(8)11(9)10/h2-4,12H,5-7H2,1H3
InChI Key:
WWOSHHFVXPUSNJ-UHFFFAOYSA-N
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.246g/mol
Monoisotopic Mass:
187.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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