[(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine

C14H13Cl3N2 — CID 107562687

IUPAC[(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2c(Cl)cccc2Cl)cc1Cl
InChIInChI=1S/C14H13Cl3N2/c1-8-5-6-9(7-12(8)17)14(19-18)13-10(15)3-2-4-11(13)16/h2-7,14,19H,18H2,1H3
InChIKeyAMDVXMCCGNSFRS-UHFFFAOYSA-N
MW315.63 g/mol
LogP4.51
Rot. Bonds3

About [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine

[(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine (PubChem CID 107562687) has the molecular formula C14H13Cl3N2 and a molecular weight of 315.63 g/mol. Its IUPAC name is [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine
PubChem CID107562687
Molecular FormulaC14H13Cl3N2
Molecular Weight315.63 g/mol
Exact Mass314.01
IUPAC Name[(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2c(Cl)cccc2Cl)cc1Cl
InChIInChI=1S/C14H13Cl3N2/c1-8-5-6-9(7-12(8)17)14(19-18)13-10(15)3-2-4-11(13)16/h2-7,14,19H,18H2,1H3
InChIKeyAMDVXMCCGNSFRS-UHFFFAOYSA-N
XLogP4.51
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.63
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine?
The IUPAC name of [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine (CID 107562687) is [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine is Cc1ccc(C(NN)c2c(Cl)cccc2Cl)cc1Cl.
What is the InChIKey of [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine?
The InChIKey is AMDVXMCCGNSFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl3N2/c1-8-5-6-9(7-12(8)17)14(19-18)13-10(15)3-2-4-11(13)16/h2-7,14,19H,18H2,1H3.
What are the key properties of [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine?
[(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine has a molecular weight of 315.63 g/mol, XLogP of 4.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-4-methylphenyl)-(2,6-dichlorophenyl)methyl]hydrazine is sourced from PubChem (CID 107562687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).