[(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine

C13H11ClF2N2 — CID 105223374

IUPAC[(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine
SMILESNNC(c1cccc(F)c1)c1cccc(Cl)c1F
InChIInChI=1S/C13H11ClF2N2/c14-11-6-2-5-10(12(11)16)13(18-17)8-3-1-4-9(15)7-8/h1-7,13,18H,17H2
InChIKeyRXFLZAFCACBXED-UHFFFAOYSA-N
MW268.69 g/mol
LogP3.17
Rot. Bonds3

About [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine

[(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine (PubChem CID 105223374) has the molecular formula C13H11ClF2N2 and a molecular weight of 268.69 g/mol. Its IUPAC name is [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine
PubChem CID105223374
Molecular FormulaC13H11ClF2N2
Molecular Weight268.69 g/mol
Exact Mass268.06
IUPAC Name[(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine
SMILESNNC(c1cccc(F)c1)c1cccc(Cl)c1F
InChIInChI=1S/C13H11ClF2N2/c14-11-6-2-5-10(12(11)16)13(18-17)8-3-1-4-9(15)7-8/h1-7,13,18H,17H2
InChIKeyRXFLZAFCACBXED-UHFFFAOYSA-N
XLogP3.17
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.69
LogP ≤ 53.17
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-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine?
The IUPAC name of [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine (CID 105223374) is [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine is NNC(c1cccc(F)c1)c1cccc(Cl)c1F.
What is the InChIKey of [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine?
The InChIKey is RXFLZAFCACBXED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClF2N2/c14-11-6-2-5-10(12(11)16)13(18-17)8-3-1-4-9(15)7-8/h1-7,13,18H,17H2.
What are the key properties of [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine?
[(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine has a molecular weight of 268.69 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-2-fluorophenyl)-(3-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105223374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).