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303-78-6 | Phenazine, 2-methoxy-, 5,10-dioxide
CAS No: 303-78-6 Catalog No: AG002ZKF MDL No:
Product Description
Catalog Number:
AG002ZKF
Chemical Name:
Phenazine, 2-methoxy-, 5,10-dioxide
CAS Number:
303-78-6
Molecular Formula:
C13H10N2O3
Molecular Weight:
242.2301
IUPAC Name:
2-methoxy-10-oxidophenazin-5-ium 5-oxide
InChI:
InChI=1S/C13H10N2O3/c1-18-9-6-7-12-13(8-9)15(17)11-5-3-2-4-10(11)14(12)16/h2-8H,1H3
InChI Key:
KEQNUKOWWOSBSJ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)[n+]([O-])c1c([n+]2[O-])cccc1
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.069g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.234g/mol
Monoisotopic Mass:
242.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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