9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol

C19H12N4O6 — CID 135525119

IUPAC9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol
SMILESO=[N+]([O-])c1ccc(NN=C2c3cc(O)ccc3-c3ccc(O)cc32)c([N+](=O)[O-])c1
InChIInChI=1S/C19H12N4O6/c24-11-2-4-13-14-5-3-12(25)9-16(14)19(15(13)8-11)21-20-17-6-1-10(22(26)27)7-18(17)23(28)29/h1-9,20,24-25H
InChIKeyFGKLEILINBYMCG-UHFFFAOYSA-N
MW392.33 g/mol
LogP3.76
Rot. Bonds4

About 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol

9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol (PubChem CID 135525119) has the molecular formula C19H12N4O6 and a molecular weight of 392.33 g/mol. Its IUPAC name is 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol.

Molecular Properties

Compound Name9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol
PubChem CID135525119
Molecular FormulaC19H12N4O6
Molecular Weight392.33 g/mol
Exact Mass392.08
IUPAC Name9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol
SMILESO=[N+]([O-])c1ccc(NN=C2c3cc(O)ccc3-c3ccc(O)cc32)c([N+](=O)[O-])c1
InChIInChI=1S/C19H12N4O6/c24-11-2-4-13-14-5-3-12(25)9-16(14)19(15(13)8-11)21-20-17-6-1-10(22(26)27)7-18(17)23(28)29/h1-9,20,24-25H
InChIKeyFGKLEILINBYMCG-UHFFFAOYSA-N
XLogP3.76
TPSA151.13 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.33
LogP ≤ 53.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol?
The IUPAC name of 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol (CID 135525119) is 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol.
What is the SMILES notation for 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol?
The canonical SMILES for 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol is O=[N+]([O-])c1ccc(NN=C2c3cc(O)ccc3-c3ccc(O)cc32)c([N+](=O)[O-])c1.
What is the InChIKey of 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol?
The InChIKey is FGKLEILINBYMCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N4O6/c24-11-2-4-13-14-5-3-12(25)9-16(14)19(15(13)8-11)21-20-17-6-1-10(22(26)27)7-18(17)23(28)29/h1-9,20,24-25H.
What are the key properties of 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol?
9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol has a molecular weight of 392.33 g/mol, XLogP of 3.76, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2,4-dinitrophenyl)hydrazinylidene]fluorene-2,7-diol is sourced from PubChem (CID 135525119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).