1-benzyl-1-(trifluoromethoxy)hydrazine

C8H9F3N2O — CID 52911263

IUPAC1-benzyl-1-(trifluoromethoxy)hydrazine
SMILESNN(Cc1ccccc1)OC(F)(F)F
InChIInChI=1S/C8H9F3N2O/c9-8(10,11)14-13(12)6-7-4-2-1-3-5-7/h1-5H,6,12H2
InChIKeyIEQGHXYOPJMLKE-UHFFFAOYSA-N
MW206.17 g/mol
LogP1.81
Rot. Bonds3

About 1-benzyl-1-(trifluoromethoxy)hydrazine

1-benzyl-1-(trifluoromethoxy)hydrazine (PubChem CID 52911263) has the molecular formula C8H9F3N2O and a molecular weight of 206.17 g/mol. Its IUPAC name is 1-benzyl-1-(trifluoromethoxy)hydrazine.

Molecular Properties

Compound Name1-benzyl-1-(trifluoromethoxy)hydrazine
PubChem CID52911263
Molecular FormulaC8H9F3N2O
Molecular Weight206.17 g/mol
Exact Mass206.07
IUPAC Name1-benzyl-1-(trifluoromethoxy)hydrazine
SMILESNN(Cc1ccccc1)OC(F)(F)F
InChIInChI=1S/C8H9F3N2O/c9-8(10,11)14-13(12)6-7-4-2-1-3-5-7/h1-5H,6,12H2
InChIKeyIEQGHXYOPJMLKE-UHFFFAOYSA-N
XLogP1.81
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.17
LogP ≤ 51.81
H-Bond Donors ≤ 51
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-benzyl-1-(4-fluorophenyl)hydrazine
CID 23043086
N-benzyl-1,1,1-trifluoro-N-methylmethanamine
CID 5167579
N'-benzyl-N'-(trifluoromethyl)ethane-1,2-diamine
CID 67641807
N'-benzyl-N'-[2-(trifluoromethoxy)ethyl]propane-1,3-diamine
CID 107367846
N-benzyl-1-phenyl-N-phosphanylmethanamine;dihydrochloride
CID 175096714
2-[amino(benzyl)amino]phenol
CID 151067188
amino(benzyl)carbamic acid
CID 18704089
N,N-dibenzyl-2-fluoro-2-propylpentan-1-amine
CID 122491448
2,2,2-trifluoroethyl N-benzyl-N-methylcarbamate
CID 65173330
phenyl(trifluoromethoxy)carbamic acid
CID 87790177
N-benzyl-N-methanidyl-1-phenylmethanamine
CID 20756684
azane;2,2,2-trifluoroethylbenzene;hydrochloride
CID 175467010

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-1-(trifluoromethoxy)hydrazine?
The IUPAC name of 1-benzyl-1-(trifluoromethoxy)hydrazine (CID 52911263) is 1-benzyl-1-(trifluoromethoxy)hydrazine.
What is the SMILES notation for 1-benzyl-1-(trifluoromethoxy)hydrazine?
The canonical SMILES for 1-benzyl-1-(trifluoromethoxy)hydrazine is NN(Cc1ccccc1)OC(F)(F)F.
What is the InChIKey of 1-benzyl-1-(trifluoromethoxy)hydrazine?
The InChIKey is IEQGHXYOPJMLKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2O/c9-8(10,11)14-13(12)6-7-4-2-1-3-5-7/h1-5H,6,12H2.
What are the key properties of 1-benzyl-1-(trifluoromethoxy)hydrazine?
1-benzyl-1-(trifluoromethoxy)hydrazine has a molecular weight of 206.17 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-1-(trifluoromethoxy)hydrazine is sourced from PubChem (CID 52911263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).