[4-nitro-2-(trifluoromethoxy)phenyl]hydrazine

C7H6F3N3O3 — CID 118807665

IUPAC[4-nitro-2-(trifluoromethoxy)phenyl]hydrazine
SMILESNNc1ccc([N+](=O)[O-])cc1OC(F)(F)F
InChIInChI=1S/C7H6F3N3O3/c8-7(9,10)16-6-3-4(13(14)15)1-2-5(6)12-11/h1-3,12H,11H2
InChIKeyZSDABKCICORIIF-UHFFFAOYSA-N
MW237.14 g/mol
LogP1.78
Rot. Bonds3

About [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine

[4-nitro-2-(trifluoromethoxy)phenyl]hydrazine (PubChem CID 118807665) has the molecular formula C7H6F3N3O3 and a molecular weight of 237.14 g/mol. Its IUPAC name is [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine.

Molecular Properties

Compound Name[4-nitro-2-(trifluoromethoxy)phenyl]hydrazine
PubChem CID118807665
Molecular FormulaC7H6F3N3O3
Molecular Weight237.14 g/mol
Exact Mass237.04
IUPAC Name[4-nitro-2-(trifluoromethoxy)phenyl]hydrazine
SMILESNNc1ccc([N+](=O)[O-])cc1OC(F)(F)F
InChIInChI=1S/C7H6F3N3O3/c8-7(9,10)16-6-3-4(13(14)15)1-2-5(6)12-11/h1-3,12H,11H2
InChIKeyZSDABKCICORIIF-UHFFFAOYSA-N
XLogP1.78
TPSA90.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.14
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-nitro-2-(trifluoromethoxy)aniline
CID 56973585
1-chloro-4-nitro-2-(trifluoromethoxy)benzene
CID 71669332
(2-methoxy-4-nitrophenyl)hydrazine;phosphoric acid
CID 138619587
2-iodo-4-nitro-1-(trifluoromethoxy)benzene
CID 56604200
[4-nitro-2-(trifluoromethoxy)phenyl]methanol
CID 171028715
[2-nitro-4-(trifluoromethoxy)phenyl]hydrazine
CID 118835724
2-(difluoromethoxy)-4-nitro-1-(trifluoromethoxy)benzene
CID 46311619
2-hydrazinyl-5-nitroaniline
CID 130769325
5-nitro-2-(trifluoromethoxy)benzamide
CID 131869132
[5-nitro-2-(trifluoromethylsulfanyl)phenyl]hydrazine
CID 118807774
ethyl 2-[4-nitro-2-(trifluoromethoxy)phenyl]acetate
CID 171028760
benzene;(2,4-dinitrophenyl)hydrazine
CID 159646359

Frequently Asked Questions

What is the IUPAC name of [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine?
The IUPAC name of [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine (CID 118807665) is [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine.
What is the SMILES notation for [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine?
The canonical SMILES for [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine is NNc1ccc([N+](=O)[O-])cc1OC(F)(F)F.
What is the InChIKey of [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine?
The InChIKey is ZSDABKCICORIIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3N3O3/c8-7(9,10)16-6-3-4(13(14)15)1-2-5(6)12-11/h1-3,12H,11H2.
What are the key properties of [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine?
[4-nitro-2-(trifluoromethoxy)phenyl]hydrazine has a molecular weight of 237.14 g/mol, XLogP of 1.78, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-nitro-2-(trifluoromethoxy)phenyl]hydrazine is sourced from PubChem (CID 118807665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).