2,6-dichlorobenzohydrazide

C7H6Cl2N2O — CID 19907604

IUPAC2,6-dichlorobenzohydrazide
SMILESNNC(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C7H6Cl2N2O/c8-4-2-1-3-5(9)6(4)7(12)11-10/h1-3H,10H2,(H,11,12)
InChIKeyRZTXCLYVFUMCQM-UHFFFAOYSA-N
MW205.04 g/mol
LogP1.60
Rot. Bonds1

About 2,6-dichlorobenzohydrazide

2,6-dichlorobenzohydrazide (PubChem CID 19907604) has the molecular formula C7H6Cl2N2O and a molecular weight of 205.04 g/mol. Its IUPAC name is 2,6-dichlorobenzohydrazide.

Molecular Properties

Compound Name2,6-dichlorobenzohydrazide
PubChem CID19907604
Molecular FormulaC7H6Cl2N2O
Molecular Weight205.04 g/mol
Exact Mass203.99
IUPAC Name2,6-dichlorobenzohydrazide
SMILESNNC(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C7H6Cl2N2O/c8-4-2-1-3-5(9)6(4)7(12)11-10/h1-3H,10H2,(H,11,12)
InChIKeyRZTXCLYVFUMCQM-UHFFFAOYSA-N
XLogP1.60
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.04
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', '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 2,6-dichlorobenzohydrazide?
The IUPAC name of 2,6-dichlorobenzohydrazide (CID 19907604) is 2,6-dichlorobenzohydrazide.
What is the SMILES notation for 2,6-dichlorobenzohydrazide?
The canonical SMILES for 2,6-dichlorobenzohydrazide is NNC(=O)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichlorobenzohydrazide?
The InChIKey is RZTXCLYVFUMCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl2N2O/c8-4-2-1-3-5(9)6(4)7(12)11-10/h1-3H,10H2,(H,11,12).
What are the key properties of 2,6-dichlorobenzohydrazide?
2,6-dichlorobenzohydrazide has a molecular weight of 205.04 g/mol, XLogP of 1.60, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichlorobenzohydrazide is sourced from PubChem (CID 19907604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).