N-(4-chlorophenyl)ethanehydrazonoyl chloride

C8H8Cl2N2 — CID 86039764

IUPACN-(4-chlorophenyl)ethanehydrazonoyl chloride
SMILESCC(Cl)=NNc1ccc(Cl)cc1
InChIInChI=1S/C8H8Cl2N2/c1-6(9)11-12-8-4-2-7(10)3-5-8/h2-5,12H,1H3
InChIKeyRGORNBKDKRTNHN-UHFFFAOYSA-N
MW203.07 g/mol
LogP3.32
Rot. Bonds2

About N-(4-chlorophenyl)ethanehydrazonoyl chloride

N-(4-chlorophenyl)ethanehydrazonoyl chloride (PubChem CID 86039764) has the molecular formula C8H8Cl2N2 and a molecular weight of 203.07 g/mol. Its IUPAC name is N-(4-chlorophenyl)ethanehydrazonoyl chloride.

Molecular Properties

Compound NameN-(4-chlorophenyl)ethanehydrazonoyl chloride
PubChem CID86039764
Molecular FormulaC8H8Cl2N2
Molecular Weight203.07 g/mol
Exact Mass202.01
IUPAC NameN-(4-chlorophenyl)ethanehydrazonoyl chloride
SMILESCC(Cl)=NNc1ccc(Cl)cc1
InChIInChI=1S/C8H8Cl2N2/c1-6(9)11-12-8-4-2-7(10)3-5-8/h2-5,12H,1H3
InChIKeyRGORNBKDKRTNHN-UHFFFAOYSA-N
XLogP3.32
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.07
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[(4-chlorophenyl)hydrazinylidene]butan-2-one
CID 4562553
N-(2,4-dichlorophenyl)ethanehydrazonoyl chloride
CID 72815031
4-chloro-N-(1-phenylethylideneamino)aniline
CID 78572712
(1E)-N-(4-nitrophenyl)ethanehydrazonoyl chloride
CID 6518748
(1Z)-2-(4-chloroanilino)-N-(4-chlorophenyl)-2-oxoethanehydrazonoyl chloride
CID 15626985
4-chloro-N-[(Z)-1-(2-fluorophenyl)ethylideneamino]aniline
CID 7937205
4-[(Z)-N-(4-chloroanilino)-C-methylcarbonimidoyl]-N,N-dimethylaniline
CID 9015378
propan-2-yl (2Z)-2-chloro-2-[(4-chlorophenyl)hydrazinylidene]acetate
CID 76845780
(3Z)-3-[(4-chlorophenyl)hydrazinylidene]-4-iminopentan-2-one
CID 101027976
(6Z)-6-[(4-chlorophenyl)hydrazinylidene]heptanoic acid
CID 134858389
ethyl (1Z)-N-(4-chloroanilino)-2-oxopropanimidothioate
CID 51413538
2-(4-chloroanilino)-1-(diaminomethylidene)guanidine;hydrochloride
CID 175205005

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)ethanehydrazonoyl chloride?
The IUPAC name of N-(4-chlorophenyl)ethanehydrazonoyl chloride (CID 86039764) is N-(4-chlorophenyl)ethanehydrazonoyl chloride.
What is the SMILES notation for N-(4-chlorophenyl)ethanehydrazonoyl chloride?
The canonical SMILES for N-(4-chlorophenyl)ethanehydrazonoyl chloride is CC(Cl)=NNc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)ethanehydrazonoyl chloride?
The InChIKey is RGORNBKDKRTNHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Cl2N2/c1-6(9)11-12-8-4-2-7(10)3-5-8/h2-5,12H,1H3.
What are the key properties of N-(4-chlorophenyl)ethanehydrazonoyl chloride?
N-(4-chlorophenyl)ethanehydrazonoyl chloride has a molecular weight of 203.07 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)ethanehydrazonoyl chloride is sourced from PubChem (CID 86039764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).