2-fluoro-4-hydrazinylbenzaldehyde

C7H7FN2O — CID 131118767

IUPAC2-fluoro-4-hydrazinylbenzaldehyde
SMILESNNc1ccc(C=O)c(F)c1
InChIInChI=1S/C7H7FN2O/c8-7-3-6(10-9)2-1-5(7)4-11/h1-4,10H,9H2
InChIKeyUBDQMWLETRDMTN-UHFFFAOYSA-N
MW154.14 g/mol
LogP0.92
Rot. Bonds2

About 2-fluoro-4-hydrazinylbenzaldehyde

2-fluoro-4-hydrazinylbenzaldehyde (PubChem CID 131118767) has the molecular formula C7H7FN2O and a molecular weight of 154.14 g/mol. Its IUPAC name is 2-fluoro-4-hydrazinylbenzaldehyde.

Molecular Properties

Compound Name2-fluoro-4-hydrazinylbenzaldehyde
PubChem CID131118767
Molecular FormulaC7H7FN2O
Molecular Weight154.14 g/mol
Exact Mass154.05
IUPAC Name2-fluoro-4-hydrazinylbenzaldehyde
SMILESNNc1ccc(C=O)c(F)c1
InChIInChI=1S/C7H7FN2O/c8-7-3-6(10-9)2-1-5(7)4-11/h1-4,10H,9H2
InChIKeyUBDQMWLETRDMTN-UHFFFAOYSA-N
XLogP0.92
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.14
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

2-amino-5-hydrazinylbenzaldehyde
CID 88668282
(3-fluoro-4-formylphenyl)carbamic acid
CID 91366122
2,6-difluoro-4-hydrazinylbenzaldehyde
CID 91195669
2-ethoxy-5-hydrazinylbenzaldehyde
CID 131214024
(4-chloro-3-fluorophenyl)hydrazine
CID 53413991
CID 88874585
CID 88874585
(3-fluoro-4-methylphenyl)hydrazine;hydrochloride
CID 44557932
4-ethenyl-2-fluorobenzaldehyde
CID 107430174
CID 145469155
CID 145469155
[4-(difluoromethyl)-3-fluorophenyl]hydrazine
CID 118801431
[4-[(3-fluoro-4-formylphenyl)methyl]phenyl]carbamic acid
CID 174187468
4,6-difluorobenzene-1,3-dicarbaldehyde
CID 11030259

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-hydrazinylbenzaldehyde?
The IUPAC name of 2-fluoro-4-hydrazinylbenzaldehyde (CID 131118767) is 2-fluoro-4-hydrazinylbenzaldehyde.
What is the SMILES notation for 2-fluoro-4-hydrazinylbenzaldehyde?
The canonical SMILES for 2-fluoro-4-hydrazinylbenzaldehyde is NNc1ccc(C=O)c(F)c1.
What is the InChIKey of 2-fluoro-4-hydrazinylbenzaldehyde?
The InChIKey is UBDQMWLETRDMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2O/c8-7-3-6(10-9)2-1-5(7)4-11/h1-4,10H,9H2.
What are the key properties of 2-fluoro-4-hydrazinylbenzaldehyde?
2-fluoro-4-hydrazinylbenzaldehyde has a molecular weight of 154.14 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-hydrazinylbenzaldehyde is sourced from PubChem (CID 131118767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).