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

C7H5F5N2 — CID 67695258

IUPAC[difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine
SMILESNNC(F)(F)c1ccc(F)c(F)c1F
InChIInChI=1S/C7H5F5N2/c8-4-2-1-3(5(9)6(4)10)7(11,12)14-13/h1-2,14H,13H2
InChIKeyXMWKRVOZXOKPIQ-UHFFFAOYSA-N
MW212.12 g/mol
LogP1.62
Rot. Bonds2

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

[difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine (PubChem CID 67695258) has the molecular formula C7H5F5N2 and a molecular weight of 212.12 g/mol. Its IUPAC name is [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine
PubChem CID67695258
Molecular FormulaC7H5F5N2
Molecular Weight212.12 g/mol
Exact Mass212.04
IUPAC Name[difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine
SMILESNNC(F)(F)c1ccc(F)c(F)c1F
InChIInChI=1S/C7H5F5N2/c8-4-2-1-3(5(9)6(4)10)7(11,12)14-13/h1-2,14H,13H2
InChIKeyXMWKRVOZXOKPIQ-UHFFFAOYSA-N
XLogP1.62
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.12
LogP ≤ 51.62
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': 'N-C-halo', '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 [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine?
The IUPAC name of [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine (CID 67695258) is [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine.
What is the SMILES notation for [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine?
The canonical SMILES for [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine is NNC(F)(F)c1ccc(F)c(F)c1F.
What is the InChIKey of [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine?
The InChIKey is XMWKRVOZXOKPIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F5N2/c8-4-2-1-3(5(9)6(4)10)7(11,12)14-13/h1-2,14H,13H2.
What are the key properties of [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine?
[difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine has a molecular weight of 212.12 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [difluoro-(2,3,4-trifluorophenyl)methyl]hydrazine is sourced from PubChem (CID 67695258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).