2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol

C7H6Cl2N2O — CID 135445572

IUPAC2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol
SMILESN/N=C/c1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C7H6Cl2N2O/c8-5-1-4(3-11-10)7(12)6(9)2-5/h1-3,12H,10H2/b11-3+
InChIKeyMFGATNXEAQDBJY-QDEBKDIKSA-N
MW205.04 g/mol
LogP1.99
Rot. Bonds1

About 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol

2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol (PubChem CID 135445572) has the molecular formula C7H6Cl2N2O and a molecular weight of 205.04 g/mol. Its IUPAC name is 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol.

Molecular Properties

Compound Name2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol
PubChem CID135445572
Molecular FormulaC7H6Cl2N2O
Molecular Weight205.04 g/mol
Exact Mass203.99
IUPAC Name2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol
SMILESN/N=C/c1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C7H6Cl2N2O/c8-5-1-4(3-11-10)7(12)6(9)2-5/h1-3,12H,10H2/b11-3+
InChIKeyMFGATNXEAQDBJY-QDEBKDIKSA-N
XLogP1.99
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.04
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-bromo-4-chloro-6-methanehydrazonoylphenol
CID 136503874
2,4-dichloro-6-[[4-[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol
CID 3279697
2,4-dichloro-6-[6-[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]hexyliminomethyl]phenol
CID 3884626
[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]urea
CID 793144
carbamothioyl-[(E)-(3,5-dichloro-2-hydroxyphenyl)methylideneamino]-dimethylazanium
CID 135781345
2,4-dichloro-6-[(3,5-dimethylphenyl)iminomethyl]phenol
CID 709091
2,4-dichloro-6-[[(1R,2S)-2-[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol
CID 2265555
3,5-dichloro-2-hydroxybenzaldehyde;palladium(2+)
CID 175867579
2,4-dichloro-6-[(3-chlorophenyl)iminomethyl]phenol
CID 710336
2-[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]-4,5-dimethylphenol
CID 590757
4-amino-N'-[(E)-(3,5-dichloro-2-hydroxyphenyl)methylideneamino]-1,2,5-oxadiazole-3-carboximidamide
CID 135688105
2,4-dichloro-6-[(E)-[(4-sulfanylphenyl)hydrazinylidene]methyl]phenol
CID 143199865

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol?
The IUPAC name of 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol (CID 135445572) is 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol.
What is the SMILES notation for 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol?
The canonical SMILES for 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol is N/N=C/c1cc(Cl)cc(Cl)c1O.
What is the InChIKey of 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol?
The InChIKey is MFGATNXEAQDBJY-QDEBKDIKSA-N. The full InChI is InChI=1S/C7H6Cl2N2O/c8-5-1-4(3-11-10)7(12)6(9)2-5/h1-3,12H,10H2/b11-3+.
What are the key properties of 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol?
2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol has a molecular weight of 205.04 g/mol, XLogP of 1.99, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-[(E)-hydrazinylidenemethyl]phenol is sourced from PubChem (CID 135445572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).