[4-(trifluoromethylsulfanyl)phenyl]hydrazine

C7H7F3N2S — CID 10420564

IUPAC[4-(trifluoromethylsulfanyl)phenyl]hydrazine
SMILESNNc1ccc(SC(F)(F)F)cc1
InChIInChI=1S/C7H7F3N2S/c8-7(9,10)13-6-3-1-5(12-11)2-4-6/h1-4,12H,11H2
InChIKeyHSKMWRFWZVOVOU-UHFFFAOYSA-N
MW208.21 g/mol
LogP2.58
Rot. Bonds2

About [4-(trifluoromethylsulfanyl)phenyl]hydrazine

[4-(trifluoromethylsulfanyl)phenyl]hydrazine (PubChem CID 10420564) has the molecular formula C7H7F3N2S and a molecular weight of 208.21 g/mol. Its IUPAC name is [4-(trifluoromethylsulfanyl)phenyl]hydrazine.

Molecular Properties

Compound Name[4-(trifluoromethylsulfanyl)phenyl]hydrazine
PubChem CID10420564
Molecular FormulaC7H7F3N2S
Molecular Weight208.21 g/mol
Exact Mass208.03
IUPAC Name[4-(trifluoromethylsulfanyl)phenyl]hydrazine
SMILESNNc1ccc(SC(F)(F)F)cc1
InChIInChI=1S/C7H7F3N2S/c8-7(9,10)13-6-3-1-5(12-11)2-4-6/h1-4,12H,11H2
InChIKeyHSKMWRFWZVOVOU-UHFFFAOYSA-N
XLogP2.58
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.21
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(trifluoromethylsulfanyl)phenyl]hydrazine?
The IUPAC name of [4-(trifluoromethylsulfanyl)phenyl]hydrazine (CID 10420564) is [4-(trifluoromethylsulfanyl)phenyl]hydrazine.
What is the SMILES notation for [4-(trifluoromethylsulfanyl)phenyl]hydrazine?
The canonical SMILES for [4-(trifluoromethylsulfanyl)phenyl]hydrazine is NNc1ccc(SC(F)(F)F)cc1.
What is the InChIKey of [4-(trifluoromethylsulfanyl)phenyl]hydrazine?
The InChIKey is HSKMWRFWZVOVOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2S/c8-7(9,10)13-6-3-1-5(12-11)2-4-6/h1-4,12H,11H2.
What are the key properties of [4-(trifluoromethylsulfanyl)phenyl]hydrazine?
[4-(trifluoromethylsulfanyl)phenyl]hydrazine has a molecular weight of 208.21 g/mol, XLogP of 2.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(trifluoromethylsulfanyl)phenyl]hydrazine is sourced from PubChem (CID 10420564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).