1-phenyl-1,2-bis(trifluoromethyl)hydrazine

C8H6F6N2 — CID 87550467

IUPAC1-phenyl-1,2-bis(trifluoromethyl)hydrazine
SMILESFC(F)(F)NN(c1ccccc1)C(F)(F)F
InChIInChI=1S/C8H6F6N2/c9-7(10,11)15-16(8(12,13)14)6-4-2-1-3-5-6/h1-5,15H
InChIKeyBMPMSIKWEHDUFM-UHFFFAOYSA-N
MW244.14 g/mol
LogP3.04
Rot. Bonds2

About 1-phenyl-1,2-bis(trifluoromethyl)hydrazine

1-phenyl-1,2-bis(trifluoromethyl)hydrazine (PubChem CID 87550467) has the molecular formula C8H6F6N2 and a molecular weight of 244.14 g/mol. Its IUPAC name is 1-phenyl-1,2-bis(trifluoromethyl)hydrazine.

Molecular Properties

Compound Name1-phenyl-1,2-bis(trifluoromethyl)hydrazine
PubChem CID87550467
Molecular FormulaC8H6F6N2
Molecular Weight244.14 g/mol
Exact Mass244.04
IUPAC Name1-phenyl-1,2-bis(trifluoromethyl)hydrazine
SMILESFC(F)(F)NN(c1ccccc1)C(F)(F)F
InChIInChI=1S/C8H6F6N2/c9-7(10,11)15-16(8(12,13)14)6-4-2-1-3-5-6/h1-5,15H
InChIKeyBMPMSIKWEHDUFM-UHFFFAOYSA-N
XLogP3.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.14
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 1-phenyl-1,2-bis(trifluoromethyl)hydrazine?
The IUPAC name of 1-phenyl-1,2-bis(trifluoromethyl)hydrazine (CID 87550467) is 1-phenyl-1,2-bis(trifluoromethyl)hydrazine.
What is the SMILES notation for 1-phenyl-1,2-bis(trifluoromethyl)hydrazine?
The canonical SMILES for 1-phenyl-1,2-bis(trifluoromethyl)hydrazine is FC(F)(F)NN(c1ccccc1)C(F)(F)F.
What is the InChIKey of 1-phenyl-1,2-bis(trifluoromethyl)hydrazine?
The InChIKey is BMPMSIKWEHDUFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F6N2/c9-7(10,11)15-16(8(12,13)14)6-4-2-1-3-5-6/h1-5,15H.
What are the key properties of 1-phenyl-1,2-bis(trifluoromethyl)hydrazine?
1-phenyl-1,2-bis(trifluoromethyl)hydrazine has a molecular weight of 244.14 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-1,2-bis(trifluoromethyl)hydrazine is sourced from PubChem (CID 87550467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).