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91438-02-7 | 7H-1,2,3-Triazolo[4,5-f]quinolin-7-one, 2,6-dihydro-2,9-dimethyl-
CAS No: 91438-02-7 Catalog No: AG006MDD MDL No:
Product Description
Catalog Number:
AG006MDD
Chemical Name:
7H-1,2,3-Triazolo[4,5-f]quinolin-7-one, 2,6-dihydro-2,9-dimethyl-
CAS Number:
91438-02-7
Molecular Formula:
C11H10N4O
Molecular Weight:
214.2233
IUPAC Name:
2,9-dimethyl-6H-triazolo[4,5-f]quinolin-7-one
InChI:
InChI=1S/C11H10N4O/c1-6-5-9(16)12-7-3-4-8-11(10(6)7)14-15(2)13-8/h3-5H,1-2H3,(H,12,16)
InChI Key:
QVUSNVLXHVXZHB-UHFFFAOYSA-N
SMILES:
Cn1nc2c(n1)c1c(C)cc(=O)[nH]c1cc2
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.085g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.228g/mol
Monoisotopic Mass:
214.085g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
59.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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