[(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

C14H11BrF4N2 — CID 105301331

IUPAC[(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1cccc(C(F)(F)F)c1)c1cccc(F)c1Br
InChIInChI=1S/C14H11BrF4N2/c15-12-10(5-2-6-11(12)16)13(21-20)8-3-1-4-9(7-8)14(17,18)19/h1-7,13,21H,20H2
InChIKeyMGQUAOPECHJDRV-UHFFFAOYSA-N
MW363.15 g/mol
LogP4.16
Rot. Bonds3

About [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine

[(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105301331) has the molecular formula C14H11BrF4N2 and a molecular weight of 363.15 g/mol. Its IUPAC name is [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105301331
Molecular FormulaC14H11BrF4N2
Molecular Weight363.15 g/mol
Exact Mass362.00
IUPAC Name[(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1cccc(C(F)(F)F)c1)c1cccc(F)c1Br
InChIInChI=1S/C14H11BrF4N2/c15-12-10(5-2-6-11(12)16)13(21-20)8-3-1-4-9(7-8)14(17,18)19/h1-7,13,21H,20H2
InChIKeyMGQUAOPECHJDRV-UHFFFAOYSA-N
XLogP4.16
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.15
LogP ≤ 54.16
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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Related Compounds

[(2,5-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301356
[(2,4-dibromophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107948178
[(4-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105192836
[(2-bromo-3-fluorophenyl)-(2-fluorophenyl)methyl]hydrazine
CID 105292326
[(2,5-dimethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193884
[(3-bromo-5-chlorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107948177
[(5-bromo-2-pyridinyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105267889
[(2-bromo-3-fluorophenyl)-(4-ethylphenyl)methyl]hydrazine
CID 105292836
[(2-bromo-3,4-difluorophenyl)-(3-fluorophenyl)methyl]hydrazine
CID 107541340
[(1,5-dimethylpyrazol-4-yl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301348
[(2-bromo-3-fluorophenyl)-(2,3-dimethylphenyl)methyl]hydrazine
CID 105300521
(2-bromo-3-fluorophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanamine
CID 102758784

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105301331) is [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is NNC(c1cccc(C(F)(F)F)c1)c1cccc(F)c1Br.
What is the InChIKey of [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is MGQUAOPECHJDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrF4N2/c15-12-10(5-2-6-11(12)16)13(21-20)8-3-1-4-9(7-8)14(17,18)19/h1-7,13,21H,20H2.
What are the key properties of [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine?
[(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 363.15 g/mol, XLogP of 4.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105301331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).