1-(2-bromo-4-chlorophenyl)ethylhydrazine

C8H10BrClN2 — CID 107996612

IUPAC1-(2-bromo-4-chlorophenyl)ethylhydrazine
SMILESCC(NN)c1ccc(Cl)cc1Br
InChIInChI=1S/C8H10BrClN2/c1-5(12-11)7-3-2-6(10)4-8(7)9/h2-5,12H,11H2,1H3
InChIKeyJEHKCGQAMOVGLN-UHFFFAOYSA-N
MW249.54 g/mol
LogP2.63
Rot. Bonds2

About 1-(2-bromo-4-chlorophenyl)ethylhydrazine

1-(2-bromo-4-chlorophenyl)ethylhydrazine (PubChem CID 107996612) has the molecular formula C8H10BrClN2 and a molecular weight of 249.54 g/mol. Its IUPAC name is 1-(2-bromo-4-chlorophenyl)ethylhydrazine.

Molecular Properties

Compound Name1-(2-bromo-4-chlorophenyl)ethylhydrazine
PubChem CID107996612
Molecular FormulaC8H10BrClN2
Molecular Weight249.54 g/mol
Exact Mass247.97
IUPAC Name1-(2-bromo-4-chlorophenyl)ethylhydrazine
SMILESCC(NN)c1ccc(Cl)cc1Br
InChIInChI=1S/C8H10BrClN2/c1-5(12-11)7-3-2-6(10)4-8(7)9/h2-5,12H,11H2,1H3
InChIKeyJEHKCGQAMOVGLN-UHFFFAOYSA-N
XLogP2.63
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.54
LogP ≤ 52.63
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 1-(2-bromo-4-chlorophenyl)ethylhydrazine?
The IUPAC name of 1-(2-bromo-4-chlorophenyl)ethylhydrazine (CID 107996612) is 1-(2-bromo-4-chlorophenyl)ethylhydrazine.
What is the SMILES notation for 1-(2-bromo-4-chlorophenyl)ethylhydrazine?
The canonical SMILES for 1-(2-bromo-4-chlorophenyl)ethylhydrazine is CC(NN)c1ccc(Cl)cc1Br.
What is the InChIKey of 1-(2-bromo-4-chlorophenyl)ethylhydrazine?
The InChIKey is JEHKCGQAMOVGLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrClN2/c1-5(12-11)7-3-2-6(10)4-8(7)9/h2-5,12H,11H2,1H3.
What are the key properties of 1-(2-bromo-4-chlorophenyl)ethylhydrazine?
1-(2-bromo-4-chlorophenyl)ethylhydrazine has a molecular weight of 249.54 g/mol, XLogP of 2.63, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromo-4-chlorophenyl)ethylhydrazine is sourced from PubChem (CID 107996612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).