benzene;formohydrazide;dihydrofluoride

C7H12F2N2O — CID 174366148

IUPACbenzene;formohydrazide;dihydrofluoride
SMILESF.F.NNC=O.c1ccccc1
InChIInChI=1S/C6H6.CH4N2O.2FH/c1-2-4-6-5-3-1;2-3-1-4;;/h1-6H;1H,2H2,(H,3,4);2*1H
InChIKeyGOJOUWFJXCDGNS-UHFFFAOYSA-N
MW178.18 g/mol
LogP0.60
Rot. Bonds1

About benzene;formohydrazide;dihydrofluoride

benzene;formohydrazide;dihydrofluoride (PubChem CID 174366148) has the molecular formula C7H12F2N2O and a molecular weight of 178.18 g/mol. Its IUPAC name is benzene;formohydrazide;dihydrofluoride.

Molecular Properties

Compound Namebenzene;formohydrazide;dihydrofluoride
PubChem CID174366148
Molecular FormulaC7H12F2N2O
Molecular Weight178.18 g/mol
Exact Mass178.09
IUPAC Namebenzene;formohydrazide;dihydrofluoride
SMILESF.F.NNC=O.c1ccccc1
InChIInChI=1S/C6H6.CH4N2O.2FH/c1-2-4-6-5-3-1;2-3-1-4;;/h1-6H;1H,2H2,(H,3,4);2*1H
InChIKeyGOJOUWFJXCDGNS-UHFFFAOYSA-N
XLogP0.60
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.18
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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 benzene;formohydrazide;dihydrofluoride?
The IUPAC name of benzene;formohydrazide;dihydrofluoride (CID 174366148) is benzene;formohydrazide;dihydrofluoride.
What is the SMILES notation for benzene;formohydrazide;dihydrofluoride?
The canonical SMILES for benzene;formohydrazide;dihydrofluoride is F.F.NNC=O.c1ccccc1.
What is the InChIKey of benzene;formohydrazide;dihydrofluoride?
The InChIKey is GOJOUWFJXCDGNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6.CH4N2O.2FH/c1-2-4-6-5-3-1;2-3-1-4;;/h1-6H;1H,2H2,(H,3,4);2*1H.
What are the key properties of benzene;formohydrazide;dihydrofluoride?
benzene;formohydrazide;dihydrofluoride has a molecular weight of 178.18 g/mol, XLogP of 0.60, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;formohydrazide;dihydrofluoride is sourced from PubChem (CID 174366148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).