[4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride

C8H10ClF3N2 — CID 72716250

IUPAC[4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride
SMILESCl.NNCc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C8H9F3N2.ClH/c9-8(10,11)7-3-1-6(2-4-7)5-13-12;/h1-4,13H,5,12H2;1H
InChIKeyWWUDXEYZLIETJZ-UHFFFAOYSA-N
MW226.63 g/mol
LogP2.09
Rot. Bonds2

About [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride

[4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride (PubChem CID 72716250) has the molecular formula C8H10ClF3N2 and a molecular weight of 226.63 g/mol. Its IUPAC name is [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride.

Molecular Properties

Compound Name[4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride
PubChem CID72716250
Molecular FormulaC8H10ClF3N2
Molecular Weight226.63 g/mol
Exact Mass226.05
IUPAC Name[4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride
SMILESCl.NNCc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C8H9F3N2.ClH/c9-8(10,11)7-3-1-6(2-4-7)5-13-12;/h1-4,13H,5,12H2;1H
InChIKeyWWUDXEYZLIETJZ-UHFFFAOYSA-N
XLogP2.09
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.63
LogP ≤ 52.09
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 [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride?
The IUPAC name of [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride (CID 72716250) is [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride.
What is the SMILES notation for [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride?
The canonical SMILES for [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride is Cl.NNCc1ccc(C(F)(F)F)cc1.
What is the InChIKey of [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride?
The InChIKey is WWUDXEYZLIETJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2.ClH/c9-8(10,11)7-3-1-6(2-4-7)5-13-12;/h1-4,13H,5,12H2;1H.
What are the key properties of [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride?
[4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride has a molecular weight of 226.63 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(trifluoromethyl)phenyl]methylhydrazine;hydrochloride is sourced from PubChem (CID 72716250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).