[(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine

C7H9F3N2 — CID 143936287

IUPAC[(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine
SMILESC=C(/C=C\C(=C)C(F)(F)F)NN
InChIInChI=1S/C7H9F3N2/c1-5(7(8,9)10)3-4-6(2)12-11/h3-4,12H,1-2,11H2/b4-3-
InChIKeyYLGUOILXHQNMHP-ARJAWSKDSA-N
MW178.16 g/mol
LogP1.64
Rot. Bonds3

About [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine

[(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine (PubChem CID 143936287) has the molecular formula C7H9F3N2 and a molecular weight of 178.16 g/mol. Its IUPAC name is [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine.

Molecular Properties

Compound Name[(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine
PubChem CID143936287
Molecular FormulaC7H9F3N2
Molecular Weight178.16 g/mol
Exact Mass178.07
IUPAC Name[(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine
SMILESC=C(/C=C\C(=C)C(F)(F)F)NN
InChIInChI=1S/C7H9F3N2/c1-5(7(8,9)10)3-4-6(2)12-11/h3-4,12H,1-2,11H2/b4-3-
InChIKeyYLGUOILXHQNMHP-ARJAWSKDSA-N
XLogP1.64
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.16
LogP ≤ 51.64
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

[3-(2,2,2-Trifluoroethyl)cyclopenta-1,3-dien-1-yl]hydrazine
CID 117622091
[(2E,4Z,6E)-1,1,1,5-tetrafluoro-4-[(Z)-prop-1-enyl]deca-2,4,6-trien-2-yl]hydrazine
CID 132050198
(1E,3E,5E)-6-hydrazinyl-3-(trifluoromethyl)octa-1,3,5-trien-1-amine
CID 138535212
(5-Fluorocyclohepta-1,4,6-trien-1-yl)hydrazine
CID 139334698
[3-(Trifluoromethyl)cyclohexa-1,3-dien-1-yl]hydrazine
CID 141911656
(6-Fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine
CID 143119737
ethane;[(2E,4E)-6-methyl-4-(trifluoromethyl)hepta-2,4,6-trien-2-yl]hydrazine
CID 143772148
[(3E,5Z)-3-fluoro-4-methylhepta-1,3,5-trien-2-yl]hydrazine
CID 143782177
3-Ethyl-6-fluoro-4-methyl-1,2-dihydropyridazine
CID 146392507
[(3E)-5-fluoro-2-methylhexa-1,3,5-trien-3-yl]hydrazine
CID 156837174
Neptunium;[4-(trifluoromethyl)benzene-3,5-diid-1-yl]hydrazine
CID 163600058
[(2E,4E)-6-methyl-4-(trifluoromethyl)hepta-2,4,6-trien-2-yl]hydrazine
CID 143772149

Frequently Asked Questions

What is the IUPAC name of [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine?
The IUPAC name of [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine (CID 143936287) is [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine.
What is the SMILES notation for [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine?
The canonical SMILES for [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine is C=C(/C=C\C(=C)C(F)(F)F)NN.
What is the InChIKey of [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine?
The InChIKey is YLGUOILXHQNMHP-ARJAWSKDSA-N. The full InChI is InChI=1S/C7H9F3N2/c1-5(7(8,9)10)3-4-6(2)12-11/h3-4,12H,1-2,11H2/b4-3-.
What are the key properties of [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine?
[(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine has a molecular weight of 178.16 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine is sourced from PubChem (CID 143936287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).