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134082-99-8 | 2,5-METHANO-1H-[1,3]DIAZEPINO[1,2-A]BENZO[D]IMIDAZOLE
CAS No: 134082-99-8 Catalog No: AG007MKH MDL No:
Product Description
Catalog Number:
AG007MKH
Chemical Name:
2,5-METHANO-1H-[1,3]DIAZEPINO[1,2-A]BENZO[D]IMIDAZOLE
CAS Number:
134082-99-8
Molecular Formula:
C12H9N3
Molecular Weight:
195.2200
IUPAC Name:
2,9,11-triazatetracyclo[10.2.1.02,10.03,8]pentadeca-1(14),3,5,7,9,12-hexaene
InChI:
InChI=1S/C12H9N3/c1-2-4-11-10(3-1)14-12-13-8-5-6-9(7-8)15(11)12/h1-6H,7H2,(H,13,14)
InChI Key:
SIXBDPANPRAZMT-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)n1c3ccc(C3)[nH]c1n2
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.225g/mol
Monoisotopic Mass:
195.08g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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