2,4-difluoro-3-methanehydrazonoylphenol

C7H6F2N2O — CID 168531641

IUPAC2,4-difluoro-3-methanehydrazonoylphenol
SMILESNN=Cc1c(F)ccc(O)c1F
InChIInChI=1S/C7H6F2N2O/c8-5-1-2-6(12)7(9)4(5)3-11-10/h1-3,12H,10H2
InChIKeySABDEHMDCNWYPQ-UHFFFAOYSA-N
MW172.13 g/mol
LogP0.96
Rot. Bonds1

About 2,4-difluoro-3-methanehydrazonoylphenol

2,4-difluoro-3-methanehydrazonoylphenol (PubChem CID 168531641) has the molecular formula C7H6F2N2O and a molecular weight of 172.13 g/mol. Its IUPAC name is 2,4-difluoro-3-methanehydrazonoylphenol.

Molecular Properties

Compound Name2,4-difluoro-3-methanehydrazonoylphenol
PubChem CID168531641
Molecular FormulaC7H6F2N2O
Molecular Weight172.13 g/mol
Exact Mass172.04
IUPAC Name2,4-difluoro-3-methanehydrazonoylphenol
SMILESNN=Cc1c(F)ccc(O)c1F
InChIInChI=1S/C7H6F2N2O/c8-5-1-2-6(12)7(9)4(5)3-11-10/h1-3,12H,10H2
InChIKeySABDEHMDCNWYPQ-UHFFFAOYSA-N
XLogP0.96
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.13
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2,4-difluoro-3-methanehydrazonoylphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2,6-difluoro-3-hydroxyphenyl)methylideneamino]guanidine
CID 168591129
[(2,6-difluoro-3-hydroxyphenyl)methylideneamino]thiourea
CID 168536553
2,4-difluorobenzene-1,3-diol
CID 10844515
2-fluoro-3,6-dihydroxybenzaldehyde
CID 84763685
2,6-difluoro-3-hydroxybenzenesulfonamide
CID 119008908
(2,4,6-trifluorophenyl)methylidenehydrazine
CID 66926379
N-[(E)-(2,6-difluoro-3-hydroxyphenyl)methylideneamino]-3-(dimethylamino)benzamide
CID 138043810
[(2,3,6-trifluorophenyl)methylideneamino]urea
CID 168531688
[(2,3,6-trifluorophenyl)methylideneamino]thiourea
CID 168534157
3-iodo-2-methanehydrazonoylphenol
CID 168531460
(E)-(3-chloro-2,4-difluorophenyl)methylidenehydrazine;ethane
CID 176569325
(3-chloro-4-fluorophenyl)methylidenehydrazine
CID 168528915

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-3-methanehydrazonoylphenol?
The IUPAC name of 2,4-difluoro-3-methanehydrazonoylphenol (CID 168531641) is 2,4-difluoro-3-methanehydrazonoylphenol.
What is the SMILES notation for 2,4-difluoro-3-methanehydrazonoylphenol?
The canonical SMILES for 2,4-difluoro-3-methanehydrazonoylphenol is NN=Cc1c(F)ccc(O)c1F.
What is the InChIKey of 2,4-difluoro-3-methanehydrazonoylphenol?
The InChIKey is SABDEHMDCNWYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O/c8-5-1-2-6(12)7(9)4(5)3-11-10/h1-3,12H,10H2.
What are the key properties of 2,4-difluoro-3-methanehydrazonoylphenol?
2,4-difluoro-3-methanehydrazonoylphenol has a molecular weight of 172.13 g/mol, XLogP of 0.96, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-3-methanehydrazonoylphenol is sourced from PubChem (CID 168531641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).