[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine

C15H16BrClN2 — CID 105261045

IUPAC[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2ccc(Cl)c(Br)c2)cc1C
InChIInChI=1S/C15H16BrClN2/c1-9-3-4-11(7-10(9)2)15(19-18)12-5-6-14(17)13(16)8-12/h3-8,15,19H,18H2,1-2H3
InChIKeySYGGTLMMWXGSHP-UHFFFAOYSA-N
MW339.66 g/mol
LogP4.27
Rot. Bonds3

About [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine

[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine (PubChem CID 105261045) has the molecular formula C15H16BrClN2 and a molecular weight of 339.66 g/mol. Its IUPAC name is [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine
PubChem CID105261045
Molecular FormulaC15H16BrClN2
Molecular Weight339.66 g/mol
Exact Mass338.02
IUPAC Name[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2ccc(Cl)c(Br)c2)cc1C
InChIInChI=1S/C15H16BrClN2/c1-9-3-4-11(7-10(9)2)15(19-18)12-5-6-14(17)13(16)8-12/h3-8,15,19H,18H2,1-2H3
InChIKeySYGGTLMMWXGSHP-UHFFFAOYSA-N
XLogP4.27
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.66
LogP ≤ 54.27
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 [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine (CID 105261045) is [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine is Cc1ccc(C(NN)c2ccc(Cl)c(Br)c2)cc1C.
What is the InChIKey of [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine?
The InChIKey is SYGGTLMMWXGSHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrClN2/c1-9-3-4-11(7-10(9)2)15(19-18)12-5-6-14(17)13(16)8-12/h3-8,15,19H,18H2,1-2H3.
What are the key properties of [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine?
[(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine has a molecular weight of 339.66 g/mol, XLogP of 4.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-4-chlorophenyl)-(3,4-dimethylphenyl)methyl]hydrazine is sourced from PubChem (CID 105261045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).