(2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride

C6H5Cl5N2 — CID 138619876

IUPAC(2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride
SMILESCl.NNc1c(Cl)cc(Cl)c(Cl)c1Cl
InChIInChI=1S/C6H4Cl4N2.ClH/c7-2-1-3(8)6(12-11)5(10)4(2)9;/h1,12H,11H2;1H
InChIKeyZHUNGENFKSMMJH-UHFFFAOYSA-N
MW282.39 g/mol
LogP4.01
Rot. Bonds1

About (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride

(2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride (PubChem CID 138619876) has the molecular formula C6H5Cl5N2 and a molecular weight of 282.39 g/mol. Its IUPAC name is (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride.

Molecular Properties

Compound Name(2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride
PubChem CID138619876
Molecular FormulaC6H5Cl5N2
Molecular Weight282.39 g/mol
Exact Mass279.89
IUPAC Name(2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride
SMILESCl.NNc1c(Cl)cc(Cl)c(Cl)c1Cl
InChIInChI=1S/C6H4Cl4N2.ClH/c7-2-1-3(8)6(12-11)5(10)4(2)9;/h1,12H,11H2;1H
InChIKeyZHUNGENFKSMMJH-UHFFFAOYSA-N
XLogP4.01
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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 (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride?
The IUPAC name of (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride (CID 138619876) is (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride.
What is the SMILES notation for (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride?
The canonical SMILES for (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride is Cl.NNc1c(Cl)cc(Cl)c(Cl)c1Cl.
What is the InChIKey of (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride?
The InChIKey is ZHUNGENFKSMMJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl4N2.ClH/c7-2-1-3(8)6(12-11)5(10)4(2)9;/h1,12H,11H2;1H.
What are the key properties of (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride?
(2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride has a molecular weight of 282.39 g/mol, XLogP of 4.01, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4,6-tetrachlorophenyl)hydrazine;hydrochloride is sourced from PubChem (CID 138619876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).