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Home > Nitro Compounds > 3682-19-7
3682-19-7 | 6-Nitro-2,3-dihydrophthalazine-1,4-dione
CAS No: 3682-19-7 Catalog No: AG003LWG MDL No:MFCD00006891
Product Description
Catalog Number:
AG003LWG
Chemical Name:
6-Nitro-2,3-dihydrophthalazine-1,4-dione
CAS Number:
3682-19-7
Molecular Formula:
C8H5N3O4
Molecular Weight:
207.1430
MDL Number:
MFCD00006891
IUPAC Name:
6-nitro-2,3-dihydrophthalazine-1,4-dione
InChI:
InChI=1S/C8H5N3O4/c12-7-5-2-1-4(11(14)15)3-6(5)8(13)10-9-7/h1-3H,(H,9,12)(H,10,13)
InChI Key:
XQFIOLKLHNOFCA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)c(=O)[nH][nH]c2=O
NSC Number:
9339
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.028g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.145g/mol
Monoisotopic Mass:
207.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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