(4-bromo-3-methylphenyl)hydrazine

C7H9BrN2 — CID 3818726

IUPAC(4-bromo-3-methylphenyl)hydrazine
SMILESCc1cc(NN)ccc1Br
InChIInChI=1S/C7H9BrN2/c1-5-4-6(10-9)2-3-7(5)8/h2-4,10H,9H2,1H3
InChIKeyNCSVEMZXVDRIRO-UHFFFAOYSA-N
MW201.07 g/mol
LogP2.04
Rot. Bonds1

About (4-bromo-3-methylphenyl)hydrazine

(4-bromo-3-methylphenyl)hydrazine (PubChem CID 3818726) has the molecular formula C7H9BrN2 and a molecular weight of 201.07 g/mol. Its IUPAC name is (4-bromo-3-methylphenyl)hydrazine.

Molecular Properties

Compound Name(4-bromo-3-methylphenyl)hydrazine
PubChem CID3818726
Molecular FormulaC7H9BrN2
Molecular Weight201.07 g/mol
Exact Mass199.99
IUPAC Name(4-bromo-3-methylphenyl)hydrazine
SMILESCc1cc(NN)ccc1Br
InChIInChI=1S/C7H9BrN2/c1-5-4-6(10-9)2-3-7(5)8/h2-4,10H,9H2,1H3
InChIKeyNCSVEMZXVDRIRO-UHFFFAOYSA-N
XLogP2.04
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.07
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 (4-bromo-3-methylphenyl)hydrazine?
The IUPAC name of (4-bromo-3-methylphenyl)hydrazine (CID 3818726) is (4-bromo-3-methylphenyl)hydrazine.
What is the SMILES notation for (4-bromo-3-methylphenyl)hydrazine?
The canonical SMILES for (4-bromo-3-methylphenyl)hydrazine is Cc1cc(NN)ccc1Br.
What is the InChIKey of (4-bromo-3-methylphenyl)hydrazine?
The InChIKey is NCSVEMZXVDRIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2/c1-5-4-6(10-9)2-3-7(5)8/h2-4,10H,9H2,1H3.
What are the key properties of (4-bromo-3-methylphenyl)hydrazine?
(4-bromo-3-methylphenyl)hydrazine has a molecular weight of 201.07 g/mol, XLogP of 2.04, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-3-methylphenyl)hydrazine is sourced from PubChem (CID 3818726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).