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

C14H13BrClFN2 — CID 107103876

IUPAC[(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine
SMILESCc1c(Cl)cccc1C(NN)c1cccc(Br)c1F
InChIInChI=1S/C14H13BrClFN2/c1-8-9(4-3-7-12(8)16)14(19-18)10-5-2-6-11(15)13(10)17/h2-7,14,19H,18H2,1H3
InChIKeyBMNINAZTTCVFKK-UHFFFAOYSA-N
MW343.63 g/mol
LogP4.10
Rot. Bonds3

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

[(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine (PubChem CID 107103876) has the molecular formula C14H13BrClFN2 and a molecular weight of 343.63 g/mol. Its IUPAC name is [(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine
PubChem CID107103876
Molecular FormulaC14H13BrClFN2
Molecular Weight343.63 g/mol
Exact Mass341.99
IUPAC Name[(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine
SMILESCc1c(Cl)cccc1C(NN)c1cccc(Br)c1F
InChIInChI=1S/C14H13BrClFN2/c1-8-9(4-3-7-12(8)16)14(19-18)10-5-2-6-11(15)13(10)17/h2-7,14,19H,18H2,1H3
InChIKeyBMNINAZTTCVFKK-UHFFFAOYSA-N
XLogP4.10
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.63
LogP ≤ 54.10
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-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine (CID 107103876) is [(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine is Cc1c(Cl)cccc1C(NN)c1cccc(Br)c1F.
What is the InChIKey of [(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine?
The InChIKey is BMNINAZTTCVFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrClFN2/c1-8-9(4-3-7-12(8)16)14(19-18)10-5-2-6-11(15)13(10)17/h2-7,14,19H,18H2,1H3.
What are the key properties of [(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine?
[(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine has a molecular weight of 343.63 g/mol, XLogP of 4.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-2-fluorophenyl)-(3-chloro-2-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 107103876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).