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25886-04-8 | 9H-IMIDAZO[4,5-F]QUINAZOLINE
CAS No: 25886-04-8 Catalog No: AG006V7O MDL No:
Product Description
Catalog Number:
AG006V7O
Chemical Name:
9H-IMIDAZO[4,5-F]QUINAZOLINE
CAS Number:
25886-04-8
Molecular Formula:
C9H6N4
Molecular Weight:
170.1707
IUPAC Name:
9H-imidazo[4,5-f]quinazoline
InChI:
InChI=1S/C9H6N4/c1-2-8-9(13-5-12-8)6-3-10-4-11-7(1)6/h1-2,4-5H,3H2
InChI Key:
LIOVKJZZRREQQM-UHFFFAOYSA-N
SMILES:
N1=CN=c2c(C1)c1N=CN=c1cc2
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.175g/mol
Monoisotopic Mass:
170.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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