(3-methoxy-2-nitrophenyl)hydrazine

C7H9N3O3 — CID 80909118

IUPAC(3-methoxy-2-nitrophenyl)hydrazine
SMILESCOc1cccc(NN)c1[N+](=O)[O-]
InChIInChI=1S/C7H9N3O3/c1-13-6-4-2-3-5(9-8)7(6)10(11)12/h2-4,9H,8H2,1H3
InChIKeyRYSWKNMONCUJJO-UHFFFAOYSA-N
MW183.17 g/mol
LogP0.89
Rot. Bonds3

About (3-methoxy-2-nitrophenyl)hydrazine

(3-methoxy-2-nitrophenyl)hydrazine (PubChem CID 80909118) has the molecular formula C7H9N3O3 and a molecular weight of 183.17 g/mol. Its IUPAC name is (3-methoxy-2-nitrophenyl)hydrazine.

Molecular Properties

Compound Name(3-methoxy-2-nitrophenyl)hydrazine
PubChem CID80909118
Molecular FormulaC7H9N3O3
Molecular Weight183.17 g/mol
Exact Mass183.06
IUPAC Name(3-methoxy-2-nitrophenyl)hydrazine
SMILESCOc1cccc(NN)c1[N+](=O)[O-]
InChIInChI=1S/C7H9N3O3/c1-13-6-4-2-3-5(9-8)7(6)10(11)12/h2-4,9H,8H2,1H3
InChIKeyRYSWKNMONCUJJO-UHFFFAOYSA-N
XLogP0.89
TPSA90.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 (3-methoxy-2-nitrophenyl)hydrazine?
The IUPAC name of (3-methoxy-2-nitrophenyl)hydrazine (CID 80909118) is (3-methoxy-2-nitrophenyl)hydrazine.
What is the SMILES notation for (3-methoxy-2-nitrophenyl)hydrazine?
The canonical SMILES for (3-methoxy-2-nitrophenyl)hydrazine is COc1cccc(NN)c1[N+](=O)[O-].
What is the InChIKey of (3-methoxy-2-nitrophenyl)hydrazine?
The InChIKey is RYSWKNMONCUJJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O3/c1-13-6-4-2-3-5(9-8)7(6)10(11)12/h2-4,9H,8H2,1H3.
What are the key properties of (3-methoxy-2-nitrophenyl)hydrazine?
(3-methoxy-2-nitrophenyl)hydrazine has a molecular weight of 183.17 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxy-2-nitrophenyl)hydrazine is sourced from PubChem (CID 80909118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).