[(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine

C14H11BrClF3N2 — CID 107997016

IUPAC[(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1ccc(Cl)cc1Br)c1ccccc1C(F)(F)F
InChIInChI=1S/C14H11BrClF3N2/c15-12-7-8(16)5-6-10(12)13(21-20)9-3-1-2-4-11(9)14(17,18)19/h1-7,13,21H,20H2
InChIKeyJTIMKUHKURQZBT-UHFFFAOYSA-N
MW379.61 g/mol
LogP4.67
Rot. Bonds3

About [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine

[(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 107997016) has the molecular formula C14H11BrClF3N2 and a molecular weight of 379.61 g/mol. Its IUPAC name is [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID107997016
Molecular FormulaC14H11BrClF3N2
Molecular Weight379.61 g/mol
Exact Mass377.97
IUPAC Name[(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1ccc(Cl)cc1Br)c1ccccc1C(F)(F)F
InChIInChI=1S/C14H11BrClF3N2/c15-12-7-8(16)5-6-10(12)13(21-20)9-3-1-2-4-11(9)14(17,18)19/h1-7,13,21H,20H2
InChIKeyJTIMKUHKURQZBT-UHFFFAOYSA-N
XLogP4.67
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.61
LogP ≤ 54.67
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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Related Compounds

[(4-chloro-2-fluorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105217891
[(2-bromo-4-chlorophenyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine
CID 114025665
[[4-bromo-2-(trifluoromethyl)phenyl]-(2-chlorophenyl)methyl]hydrazine
CID 105212774
[(2-bromo-4-chlorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 107997211
[(4-bromo-3-chloro-2-fluorophenyl)-(2-bromo-4-chlorophenyl)methyl]hydrazine
CID 107997423
[(2-bromo-4-chlorophenyl)-(4-chlorophenyl)methyl]hydrazine
CID 107996581
[(2-bromo-4-chlorophenyl)-quinolin-8-ylmethyl]hydrazine
CID 107997224
[(2-bromo-4-chlorophenyl)-(3,5-difluorophenyl)methyl]hydrazine
CID 107996986
[(5-bromo-2-methylphenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105304800
2-[bromo-[2-(trifluoromethyl)phenyl]methyl]-1,4-dichlorobenzene
CID 63444855
1-(2-bromo-4-chlorophenyl)ethylhydrazine
CID 107996612
[[4-bromo-2-(trifluoromethyl)phenyl]-(3-chlorophenyl)methyl]hydrazine
CID 105212866

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine (CID 107997016) is [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine is NNC(c1ccc(Cl)cc1Br)c1ccccc1C(F)(F)F.
What is the InChIKey of [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is JTIMKUHKURQZBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClF3N2/c15-12-7-8(16)5-6-10(12)13(21-20)9-3-1-2-4-11(9)14(17,18)19/h1-7,13,21H,20H2.
What are the key properties of [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine?
[(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 379.61 g/mol, XLogP of 4.67, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-4-chlorophenyl)-[2-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 107997016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).