[1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine

C14H12BrCl3N2 — CID 105296864

IUPAC[1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)c(Cl)c1)c1ccc(Br)cc1Cl
InChIInChI=1S/C14H12BrCl3N2/c15-9-2-3-10(12(17)7-9)14(20-19)6-8-1-4-11(16)13(18)5-8/h1-5,7,14,20H,6,19H2
InChIKeyFGJFGMXNESRSTE-UHFFFAOYSA-N
MW394.53 g/mol
LogP5.16
Rot. Bonds4

About [1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine

[1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine (PubChem CID 105296864) has the molecular formula C14H12BrCl3N2 and a molecular weight of 394.53 g/mol. Its IUPAC name is [1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine
PubChem CID105296864
Molecular FormulaC14H12BrCl3N2
Molecular Weight394.53 g/mol
Exact Mass391.92
IUPAC Name[1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)c(Cl)c1)c1ccc(Br)cc1Cl
InChIInChI=1S/C14H12BrCl3N2/c15-9-2-3-10(12(17)7-9)14(20-19)6-8-1-4-11(16)13(18)5-8/h1-5,7,14,20H,6,19H2
InChIKeyFGJFGMXNESRSTE-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-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine (CID 105296864) is [1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine is NNC(Cc1ccc(Cl)c(Cl)c1)c1ccc(Br)cc1Cl.
What is the InChIKey of [1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine?
The InChIKey is FGJFGMXNESRSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrCl3N2/c15-9-2-3-10(12(17)7-9)14(20-19)6-8-1-4-11(16)13(18)5-8/h1-5,7,14,20H,6,19H2.
What are the key properties of [1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine?
[1-(4-bromo-2-chlorophenyl)-2-(3,4-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-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105296864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).