[2-iodo-5-(trifluoromethoxy)phenyl]hydrazine

C7H6F3IN2O — CID 118852597

IUPAC[2-iodo-5-(trifluoromethoxy)phenyl]hydrazine
SMILESNNc1cc(OC(F)(F)F)ccc1I
InChIInChI=1S/C7H6F3IN2O/c8-7(9,10)14-4-1-2-5(11)6(3-4)13-12/h1-3,13H,12H2
InChIKeyLINOQEUDOQJIFP-UHFFFAOYSA-N
MW318.04 g/mol
LogP2.48
Rot. Bonds2

About [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine

[2-iodo-5-(trifluoromethoxy)phenyl]hydrazine (PubChem CID 118852597) has the molecular formula C7H6F3IN2O and a molecular weight of 318.04 g/mol. Its IUPAC name is [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine.

Molecular Properties

Compound Name[2-iodo-5-(trifluoromethoxy)phenyl]hydrazine
PubChem CID118852597
Molecular FormulaC7H6F3IN2O
Molecular Weight318.04 g/mol
Exact Mass317.95
IUPAC Name[2-iodo-5-(trifluoromethoxy)phenyl]hydrazine
SMILESNNc1cc(OC(F)(F)F)ccc1I
InChIInChI=1S/C7H6F3IN2O/c8-7(9,10)14-4-1-2-5(11)6(3-4)13-12/h1-3,13H,12H2
InChIKeyLINOQEUDOQJIFP-UHFFFAOYSA-N
XLogP2.48
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.04
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-bromo-5-(trifluoromethoxy)phenyl]hydrazine;hydrochloride
CID 171026577
1-iodo-2-methoxy-4-(trifluoromethoxy)benzene
CID 53415972
[3-iodo-2-(trifluoromethoxy)phenyl]hydrazine
CID 118813241
[2-nitro-4-(trifluoromethoxy)phenyl]hydrazine
CID 118835724
2-iodo-1-methyl-4-(trifluoromethoxy)benzene
CID 146710880
2-iodo-N,N-dimethyl-5-(trifluoromethoxy)aniline
CID 118830517
[2-(hydrazinecarbonyl)-5-(trifluoromethoxy)phenyl]urea
CID 166747520
methyl 2-[2-iodo-4-(trifluoromethoxy)phenyl]acetate
CID 170998361
1-iodo-4-methoxy-2-(trifluoromethoxy)benzene
CID 53415973
3-chloro-1-[2-iodo-5-(trifluoromethoxy)phenyl]propan-1-one
CID 134638540
N-(2-iodophenyl)-4-(trifluoromethoxy)benzenesulfonamide
CID 26952500
2-amino-4-(trifluoromethoxy)benzenethiol
CID 154381732

Frequently Asked Questions

What is the IUPAC name of [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine?
The IUPAC name of [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine (CID 118852597) is [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine.
What is the SMILES notation for [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine?
The canonical SMILES for [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine is NNc1cc(OC(F)(F)F)ccc1I.
What is the InChIKey of [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine?
The InChIKey is LINOQEUDOQJIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3IN2O/c8-7(9,10)14-4-1-2-5(11)6(3-4)13-12/h1-3,13H,12H2.
What are the key properties of [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine?
[2-iodo-5-(trifluoromethoxy)phenyl]hydrazine has a molecular weight of 318.04 g/mol, XLogP of 2.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-iodo-5-(trifluoromethoxy)phenyl]hydrazine is sourced from PubChem (CID 118852597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).