(2-methyl-5-nitrophenyl)hydrazine

C7H9N3O2 — CID 3918674

IUPAC(2-methyl-5-nitrophenyl)hydrazine
SMILESCc1ccc([N+](=O)[O-])cc1NN
InChIInChI=1S/C7H9N3O2/c1-5-2-3-6(10(11)12)4-7(5)9-8/h2-4,9H,8H2,1H3
InChIKeyZMHHLAAPJJAADE-UHFFFAOYSA-N
MW167.17 g/mol
LogP1.19
Rot. Bonds2

About (2-methyl-5-nitrophenyl)hydrazine

(2-methyl-5-nitrophenyl)hydrazine (PubChem CID 3918674) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is (2-methyl-5-nitrophenyl)hydrazine.

Molecular Properties

Compound Name(2-methyl-5-nitrophenyl)hydrazine
PubChem CID3918674
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name(2-methyl-5-nitrophenyl)hydrazine
SMILESCc1ccc([N+](=O)[O-])cc1NN
InChIInChI=1S/C7H9N3O2/c1-5-2-3-6(10(11)12)4-7(5)9-8/h2-4,9H,8H2,1H3
InChIKeyZMHHLAAPJJAADE-UHFFFAOYSA-N
XLogP1.19
TPSA81.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-methyl-5-nitrophenyl)hydrazine?
The IUPAC name of (2-methyl-5-nitrophenyl)hydrazine (CID 3918674) is (2-methyl-5-nitrophenyl)hydrazine.
What is the SMILES notation for (2-methyl-5-nitrophenyl)hydrazine?
The canonical SMILES for (2-methyl-5-nitrophenyl)hydrazine is Cc1ccc([N+](=O)[O-])cc1NN.
What is the InChIKey of (2-methyl-5-nitrophenyl)hydrazine?
The InChIKey is ZMHHLAAPJJAADE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-5-2-3-6(10(11)12)4-7(5)9-8/h2-4,9H,8H2,1H3.
What are the key properties of (2-methyl-5-nitrophenyl)hydrazine?
(2-methyl-5-nitrophenyl)hydrazine has a molecular weight of 167.17 g/mol, XLogP of 1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-5-nitrophenyl)hydrazine is sourced from PubChem (CID 3918674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).