(2,4-dinitrophenyl)hydrazine

C6H6N4O4 — CID 3772977

IUPAC(2,4-dinitrophenyl)hydrazine
SMILESNNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]
InChIInChI=1S/C6H6N4O4/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14/h1-3,8H,7H2
InChIKeyHORQAOAYAYGIBM-UHFFFAOYSA-N
MW198.14 g/mol
LogP0.79
Rot. Bonds3

About (2,4-dinitrophenyl)hydrazine

(2,4-dinitrophenyl)hydrazine (PubChem CID 3772977) has the molecular formula C6H6N4O4 and a molecular weight of 198.14 g/mol. Its IUPAC name is (2,4-dinitrophenyl)hydrazine.

Molecular Properties

Compound Name(2,4-dinitrophenyl)hydrazine
PubChem CID3772977
Molecular FormulaC6H6N4O4
Molecular Weight198.14 g/mol
Exact Mass198.04
IUPAC Name(2,4-dinitrophenyl)hydrazine
SMILESNNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]
InChIInChI=1S/C6H6N4O4/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14/h1-3,8H,7H2
InChIKeyHORQAOAYAYGIBM-UHFFFAOYSA-N
XLogP0.79
TPSA124.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.14
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 (2,4-dinitrophenyl)hydrazine?
The IUPAC name of (2,4-dinitrophenyl)hydrazine (CID 3772977) is (2,4-dinitrophenyl)hydrazine.
What is the SMILES notation for (2,4-dinitrophenyl)hydrazine?
The canonical SMILES for (2,4-dinitrophenyl)hydrazine is NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-].
What is the InChIKey of (2,4-dinitrophenyl)hydrazine?
The InChIKey is HORQAOAYAYGIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4O4/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14/h1-3,8H,7H2.
What are the key properties of (2,4-dinitrophenyl)hydrazine?
(2,4-dinitrophenyl)hydrazine has a molecular weight of 198.14 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dinitrophenyl)hydrazine is sourced from PubChem (CID 3772977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).