(4-chloro-2-ethylphenyl)methylidenehydrazine

C9H11ClN2 — CID 168530938

IUPAC(4-chloro-2-ethylphenyl)methylidenehydrazine
SMILESCCc1cc(Cl)ccc1C=NN
InChIInChI=1S/C9H11ClN2/c1-2-7-5-9(10)4-3-8(7)6-12-11/h3-6H,2,11H2,1H3
InChIKeyIZLRWXPYQXUFQV-UHFFFAOYSA-N
MW182.65 g/mol
LogP2.19
Rot. Bonds2

About (4-chloro-2-ethylphenyl)methylidenehydrazine

(4-chloro-2-ethylphenyl)methylidenehydrazine (PubChem CID 168530938) has the molecular formula C9H11ClN2 and a molecular weight of 182.65 g/mol. Its IUPAC name is (4-chloro-2-ethylphenyl)methylidenehydrazine.

Molecular Properties

Compound Name(4-chloro-2-ethylphenyl)methylidenehydrazine
PubChem CID168530938
Molecular FormulaC9H11ClN2
Molecular Weight182.65 g/mol
Exact Mass182.06
IUPAC Name(4-chloro-2-ethylphenyl)methylidenehydrazine
SMILESCCc1cc(Cl)ccc1C=NN
InChIInChI=1S/C9H11ClN2/c1-2-7-5-9(10)4-3-8(7)6-12-11/h3-6H,2,11H2,1H3
InChIKeyIZLRWXPYQXUFQV-UHFFFAOYSA-N
XLogP2.19
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.65
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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'}

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Frequently Asked Questions

What is the IUPAC name of (4-chloro-2-ethylphenyl)methylidenehydrazine?
The IUPAC name of (4-chloro-2-ethylphenyl)methylidenehydrazine (CID 168530938) is (4-chloro-2-ethylphenyl)methylidenehydrazine.
What is the SMILES notation for (4-chloro-2-ethylphenyl)methylidenehydrazine?
The canonical SMILES for (4-chloro-2-ethylphenyl)methylidenehydrazine is CCc1cc(Cl)ccc1C=NN.
What is the InChIKey of (4-chloro-2-ethylphenyl)methylidenehydrazine?
The InChIKey is IZLRWXPYQXUFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2/c1-2-7-5-9(10)4-3-8(7)6-12-11/h3-6H,2,11H2,1H3.
What are the key properties of (4-chloro-2-ethylphenyl)methylidenehydrazine?
(4-chloro-2-ethylphenyl)methylidenehydrazine has a molecular weight of 182.65 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2-ethylphenyl)methylidenehydrazine is sourced from PubChem (CID 168530938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).