1-fluorobut-1-enylhydrazine

C4H9FN2 — CID 174399831

IUPAC1-fluorobut-1-enylhydrazine
SMILESCCC=C(F)NN
InChIInChI=1S/C4H9FN2/c1-2-3-4(5)7-6/h3,7H,2,6H2,1H3
InChIKeyHVGCLNKARVDWFU-UHFFFAOYSA-N
MW104.13 g/mol
LogP0.67
Rot. Bonds2

About 1-fluorobut-1-enylhydrazine

1-fluorobut-1-enylhydrazine (PubChem CID 174399831) has the molecular formula C4H9FN2 and a molecular weight of 104.13 g/mol. Its IUPAC name is 1-fluorobut-1-enylhydrazine.

Molecular Properties

Compound Name1-fluorobut-1-enylhydrazine
PubChem CID174399831
Molecular FormulaC4H9FN2
Molecular Weight104.13 g/mol
Exact Mass104.07
IUPAC Name1-fluorobut-1-enylhydrazine
SMILESCCC=C(F)NN
InChIInChI=1S/C4H9FN2/c1-2-3-4(5)7-6/h3,7H,2,6H2,1H3
InChIKeyHVGCLNKARVDWFU-UHFFFAOYSA-N
XLogP0.67
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.13
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-fluorobut-1-enylhydrazine?
The IUPAC name of 1-fluorobut-1-enylhydrazine (CID 174399831) is 1-fluorobut-1-enylhydrazine.
What is the SMILES notation for 1-fluorobut-1-enylhydrazine?
The canonical SMILES for 1-fluorobut-1-enylhydrazine is CCC=C(F)NN.
What is the InChIKey of 1-fluorobut-1-enylhydrazine?
The InChIKey is HVGCLNKARVDWFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FN2/c1-2-3-4(5)7-6/h3,7H,2,6H2,1H3.
What are the key properties of 1-fluorobut-1-enylhydrazine?
1-fluorobut-1-enylhydrazine has a molecular weight of 104.13 g/mol, XLogP of 0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluorobut-1-enylhydrazine is sourced from PubChem (CID 174399831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).