[3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine

C13H11F3N2O — CID 154827771

IUPAC[3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine
SMILESNNc1cccc(-c2ccccc2OC(F)(F)F)c1
InChIInChI=1S/C13H11F3N2O/c14-13(15,16)19-12-7-2-1-6-11(12)9-4-3-5-10(8-9)18-17/h1-8,18H,17H2
InChIKeyWIYLYRWCQKKBIV-UHFFFAOYSA-N
MW268.24 g/mol
LogP3.54
Rot. Bonds3

About [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine

[3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine (PubChem CID 154827771) has the molecular formula C13H11F3N2O and a molecular weight of 268.24 g/mol. Its IUPAC name is [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine.

Molecular Properties

Compound Name[3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine
PubChem CID154827771
Molecular FormulaC13H11F3N2O
Molecular Weight268.24 g/mol
Exact Mass268.08
IUPAC Name[3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine
SMILESNNc1cccc(-c2ccccc2OC(F)(F)F)c1
InChIInChI=1S/C13H11F3N2O/c14-13(15,16)19-12-7-2-1-6-11(12)9-4-3-5-10(8-9)18-17/h1-8,18H,17H2
InChIKeyWIYLYRWCQKKBIV-UHFFFAOYSA-N
XLogP3.54
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.24
LogP ≤ 53.54
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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Related Compounds

1-fluoro-3-[2-(trifluoromethoxy)phenyl]benzene
CID 46313769
1-methyl-3-[2-(trifluoromethoxy)phenyl]benzene
CID 69482191
[3-[2-(trifluoromethyl)phenyl]phenyl]hydrazine;hydrochloride
CID 171157644
1-(trifluoromethoxy)-2-[2-(trifluoromethoxy)phenyl]benzene
CID 18785200
2-fluoro-1-(trifluoromethoxy)-4-[2-(trifluoromethoxy)phenyl]benzene
CID 118811736
4-[2-(trifluoromethoxy)phenyl]aniline
CID 16768545
4-[2-(trifluoromethoxy)phenyl]-2-(trifluoromethyl)aniline
CID 118805901
1-(trifluoromethoxy)-2-[4-(trifluoromethoxy)phenyl]benzene
CID 90959680
5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine
CID 11209672
2-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]propanoic acid
CID 176514239
4-amino-6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyrimidine-2-carboxamide
CID 11360822
[2-oxo-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]ethyl] acetate
CID 58832520

Frequently Asked Questions

What is the IUPAC name of [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine?
The IUPAC name of [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine (CID 154827771) is [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine.
What is the SMILES notation for [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine?
The canonical SMILES for [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine is NNc1cccc(-c2ccccc2OC(F)(F)F)c1.
What is the InChIKey of [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine?
The InChIKey is WIYLYRWCQKKBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3N2O/c14-13(15,16)19-12-7-2-1-6-11(12)9-4-3-5-10(8-9)18-17/h1-8,18H,17H2.
What are the key properties of [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine?
[3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine has a molecular weight of 268.24 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-(trifluoromethoxy)phenyl]phenyl]hydrazine is sourced from PubChem (CID 154827771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).