[(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine

C13H9BrClF3N2 — CID 105305713

IUPAC[(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(Br)c(Cl)c1)c1ccc(F)c(F)c1F
InChIInChI=1S/C13H9BrClF3N2/c14-8-3-1-6(5-9(8)15)13(20-19)7-2-4-10(16)12(18)11(7)17/h1-5,13,20H,19H2
InChIKeyVNSLSODEWHLBBV-UHFFFAOYSA-N
MW365.58 g/mol
LogP4.07
Rot. Bonds3

About [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine

[(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine (PubChem CID 105305713) has the molecular formula C13H9BrClF3N2 and a molecular weight of 365.58 g/mol. Its IUPAC name is [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
PubChem CID105305713
Molecular FormulaC13H9BrClF3N2
Molecular Weight365.58 g/mol
Exact Mass363.96
IUPAC Name[(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(Br)c(Cl)c1)c1ccc(F)c(F)c1F
InChIInChI=1S/C13H9BrClF3N2/c14-8-3-1-6(5-9(8)15)13(20-19)7-2-4-10(16)12(18)11(7)17/h1-5,13,20H,19H2
InChIKeyVNSLSODEWHLBBV-UHFFFAOYSA-N
XLogP4.07
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.58
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

[(4-bromo-3-chlorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 103397729
[(3-bromo-5-fluorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105238523
[(3-fluoro-4-methylphenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 105201418
[(2-bromo-4-chlorophenyl)-(3,4-dichlorophenyl)methyl]hydrazine
CID 107996585
[(4-bromo-3-chloro-2-fluorophenyl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 106765223
[(4-bromo-3-chlorophenyl)-(2,3-dichlorophenyl)methyl]hydrazine
CID 105301694
[(2-bromo-4-chlorophenyl)-(4-chlorophenyl)methyl]hydrazine
CID 107996581
[(2,4-dibromophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine
CID 107948222
[(4-chloro-3-fluorophenyl)-(2,3-difluoro-4-methylphenyl)methyl]hydrazine
CID 107997445
[(3-bromo-4-fluorophenyl)-(2-chlorophenyl)methyl]hydrazine
CID 105263983
[(4-bromo-2-chlorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105304998
[(4-chlorophenyl)-(2,3-difluorophenyl)methyl]hydrazine
CID 105193293

Frequently Asked Questions

What is the IUPAC name of [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine?
The IUPAC name of [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine (CID 105305713) is [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine?
The canonical SMILES for [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine is NNC(c1ccc(Br)c(Cl)c1)c1ccc(F)c(F)c1F.
What is the InChIKey of [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine?
The InChIKey is VNSLSODEWHLBBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrClF3N2/c14-8-3-1-6(5-9(8)15)13(20-19)7-2-4-10(16)12(18)11(7)17/h1-5,13,20H,19H2.
What are the key properties of [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine?
[(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine has a molecular weight of 365.58 g/mol, XLogP of 4.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-3-chlorophenyl)-(2,3,4-trifluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105305713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).