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20144-02-9 | 1H-Indole-2,3-dione, 1-acetyl-, 3-[2-(2-nitrophenyl)hydrazone]
CAS No: 20144-02-9 Catalog No: AG002DEP MDL No:
Product Description
Catalog Number:
AG002DEP
Chemical Name:
1H-Indole-2,3-dione, 1-acetyl-, 3-[2-(2-nitrophenyl)hydrazone]
CAS Number:
20144-02-9
Molecular Formula:
C16H13N4O4-
Molecular Weight:
325.2988
IUPAC Name:
1-[2-hydroxy-3-[(2-nitrophenyl)diazenyl]indol-1-yl]ethanone
InChI:
InChI=1S/C16H12N4O4/c1-10(21)19-13-8-4-2-6-11(13)15(16(19)22)18-17-12-7-3-5-9-14(12)20(23)24/h2-9,22H,1H3
InChI Key:
BUUSRMPLZKUKHR-UHFFFAOYSA-N
SMILES:
CC(=O)N1C(=O)C(=NNc2ccccc2N(O)[O-])c2c1cccc2
NSC Number:
111852
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.086g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.296g/mol
Monoisotopic Mass:
324.086g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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