[(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine

C13H10ClF3N2 — CID 105280098

IUPAC[(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
SMILESNNC(c1cc(F)ccc1F)c1cc(Cl)ccc1F
InChIInChI=1S/C13H10ClF3N2/c14-7-1-3-11(16)9(5-7)13(19-18)10-6-8(15)2-4-12(10)17/h1-6,13,19H,18H2
InChIKeyAGASNTOXFMSXPR-UHFFFAOYSA-N
MW286.68 g/mol
LogP3.31
Rot. Bonds3

About [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine

[(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine (PubChem CID 105280098) has the molecular formula C13H10ClF3N2 and a molecular weight of 286.68 g/mol. Its IUPAC name is [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
PubChem CID105280098
Molecular FormulaC13H10ClF3N2
Molecular Weight286.68 g/mol
Exact Mass286.05
IUPAC Name[(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
SMILESNNC(c1cc(F)ccc1F)c1cc(Cl)ccc1F
InChIInChI=1S/C13H10ClF3N2/c14-7-1-3-11(16)9(5-7)13(19-18)10-6-8(15)2-4-12(10)17/h1-6,13,19H,18H2
InChIKeyAGASNTOXFMSXPR-UHFFFAOYSA-N
XLogP3.31
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.68
LogP ≤ 53.31
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 [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine?
The IUPAC name of [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine (CID 105280098) is [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine?
The canonical SMILES for [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine is NNC(c1cc(F)ccc1F)c1cc(Cl)ccc1F.
What is the InChIKey of [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine?
The InChIKey is AGASNTOXFMSXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClF3N2/c14-7-1-3-11(16)9(5-7)13(19-18)10-6-8(15)2-4-12(10)17/h1-6,13,19H,18H2.
What are the key properties of [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine?
[(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine has a molecular weight of 286.68 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-chloro-2-fluorophenyl)-(2,5-difluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105280098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).