[1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine

C14H12BrCl3N2 — CID 114269201

IUPAC[1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)cc1Cl)c1c(Cl)cccc1Br
InChIInChI=1S/C14H12BrCl3N2/c15-10-2-1-3-11(17)14(10)13(20-19)6-8-4-5-9(16)7-12(8)18/h1-5,7,13,20H,6,19H2
InChIKeyVPOPJVUMFFZYRX-UHFFFAOYSA-N
MW394.53 g/mol
LogP5.16
Rot. Bonds4

About [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine

[1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine (PubChem CID 114269201) has the molecular formula C14H12BrCl3N2 and a molecular weight of 394.53 g/mol. Its IUPAC name is [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
PubChem CID114269201
Molecular FormulaC14H12BrCl3N2
Molecular Weight394.53 g/mol
Exact Mass391.92
IUPAC Name[1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)cc1Cl)c1c(Cl)cccc1Br
InChIInChI=1S/C14H12BrCl3N2/c15-10-2-1-3-11(17)14(10)13(20-19)6-8-4-5-9(16)7-12(8)18/h1-5,7,13,20H,6,19H2
InChIKeyVPOPJVUMFFZYRX-UHFFFAOYSA-N
XLogP5.16
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.53
LogP ≤ 55.16
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-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine (CID 114269201) is [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine is NNC(Cc1ccc(Cl)cc1Cl)c1c(Cl)cccc1Br.
What is the InChIKey of [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine?
The InChIKey is VPOPJVUMFFZYRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrCl3N2/c15-10-2-1-3-11(17)14(10)13(20-19)6-8-4-5-9(16)7-12(8)18/h1-5,7,13,20H,6,19H2.
What are the key properties of [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine?
[1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine has a molecular weight of 394.53 g/mol, XLogP of 5.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-6-chlorophenyl)-2-(2,4-dichlorophenyl)ethyl]hydrazine is sourced from PubChem (CID 114269201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).