[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine

C13H9BrF4N2 — CID 105303288

IUPAC[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)cc1F)c1c(F)cc(Br)cc1F
InChIInChI=1S/C13H9BrF4N2/c14-6-3-10(17)12(11(18)4-6)13(20-19)8-2-1-7(15)5-9(8)16/h1-5,13,20H,19H2
InChIKeyUMELTFSEYJIORA-UHFFFAOYSA-N
MW349.13 g/mol
LogP3.56
Rot. Bonds3

About [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine

[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine (PubChem CID 105303288) has the molecular formula C13H9BrF4N2 and a molecular weight of 349.13 g/mol. Its IUPAC name is [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
PubChem CID105303288
Molecular FormulaC13H9BrF4N2
Molecular Weight349.13 g/mol
Exact Mass347.99
IUPAC Name[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)cc1F)c1c(F)cc(Br)cc1F
InChIInChI=1S/C13H9BrF4N2/c14-6-3-10(17)12(11(18)4-6)13(20-19)8-2-1-7(15)5-9(8)16/h1-5,13,20H,19H2
InChIKeyUMELTFSEYJIORA-UHFFFAOYSA-N
XLogP3.56
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.13
LogP ≤ 53.56
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 [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine?
The IUPAC name of [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine (CID 105303288) is [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine?
The canonical SMILES for [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine is NNC(c1ccc(F)cc1F)c1c(F)cc(Br)cc1F.
What is the InChIKey of [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine?
The InChIKey is UMELTFSEYJIORA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrF4N2/c14-6-3-10(17)12(11(18)4-6)13(20-19)8-2-1-7(15)5-9(8)16/h1-5,13,20H,19H2.
What are the key properties of [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine?
[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine has a molecular weight of 349.13 g/mol, XLogP of 3.56, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105303288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).