[(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine

C13H8F6N2 — CID 105305720

IUPAC[(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)c(F)c1F)c1c(F)cc(F)cc1F
InChIInChI=1S/C13H8F6N2/c14-5-3-8(16)10(9(17)4-5)13(21-20)6-1-2-7(15)12(19)11(6)18/h1-4,13,21H,20H2
InChIKeyGOAPZQSIJLMXCP-UHFFFAOYSA-N
MW306.21 g/mol
LogP3.07
Rot. Bonds3

About [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine

[(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine (PubChem CID 105305720) has the molecular formula C13H8F6N2 and a molecular weight of 306.21 g/mol. Its IUPAC name is [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine
PubChem CID105305720
Molecular FormulaC13H8F6N2
Molecular Weight306.21 g/mol
Exact Mass306.06
IUPAC Name[(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)c(F)c1F)c1c(F)cc(F)cc1F
InChIInChI=1S/C13H8F6N2/c14-5-3-8(16)10(9(17)4-5)13(21-20)6-1-2-7(15)12(19)11(6)18/h1-4,13,21H,20H2
InChIKeyGOAPZQSIJLMXCP-UHFFFAOYSA-N
XLogP3.07
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.21
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2,4-difluorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105216507
[(3-bromo-5-fluorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105238523
[(4-bromo-2-fluorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105280809
[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
CID 105303288
[(2,4-dibromophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 107948222
[(4-bromo-2,6-difluorophenyl)-(2,3-difluorophenyl)methyl]hydrazine
CID 105309429
[(2,3-difluoro-4-methylphenyl)-(2,6-difluorophenyl)methyl]hydrazine
CID 107516449
[(3-fluoro-4-methylphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105201418
[1-benzofuran-2-yl-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105218310
[thiophen-3-yl-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105196682
[(2-methylsulfanylphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105305698
[(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105305713

Frequently Asked Questions

What is the IUPAC name of [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine?
The IUPAC name of [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine (CID 105305720) is [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine?
The canonical SMILES for [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine is NNC(c1ccc(F)c(F)c1F)c1c(F)cc(F)cc1F.
What is the InChIKey of [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine?
The InChIKey is GOAPZQSIJLMXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F6N2/c14-5-3-8(16)10(9(17)4-5)13(21-20)6-1-2-7(15)12(19)11(6)18/h1-4,13,21H,20H2.
What are the key properties of [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine?
[(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine has a molecular weight of 306.21 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,3,4-trifluorophenyl)-(2,4,6-trifluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105305720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).