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209-30-3 | 6H-Imidazo[1,5,4-de]quinoxaline
CAS No: 209-30-3 Catalog No: AG002K04 MDL No:
Product Description
Catalog Number:
AG002K04
Chemical Name:
6H-Imidazo[1,5,4-de]quinoxaline
CAS Number:
209-30-3
Molecular Formula:
C9H7N3
Molecular Weight:
157.1720
IUPAC Name:
1,3,9-triazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7,10-pentaene
InChI:
InChI=1S/C9H7N3/c1-2-7-9-8(3-1)11-6-12(9)5-4-10-7/h1-6,10H
InChI Key:
UDILIWAITCTBJM-UHFFFAOYSA-N
SMILES:
c1cc2ncn3c2c(c1)[nH]cc3
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.176g/mol
Monoisotopic Mass:
157.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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