[(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine

C14H11BrF4N2 — CID 107292244

IUPAC[(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1cccc(Br)c1)c1ccc(F)c(C(F)(F)F)c1
InChIInChI=1S/C14H11BrF4N2/c15-10-3-1-2-8(6-10)13(21-20)9-4-5-12(16)11(7-9)14(17,18)19/h1-7,13,21H,20H2
InChIKeyXMNZXFJTSCZQKE-UHFFFAOYSA-N
MW363.15 g/mol
LogP4.16
Rot. Bonds3

About [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine

[(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 107292244) has the molecular formula C14H11BrF4N2 and a molecular weight of 363.15 g/mol. Its IUPAC name is [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID107292244
Molecular FormulaC14H11BrF4N2
Molecular Weight363.15 g/mol
Exact Mass362.00
IUPAC Name[(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1cccc(Br)c1)c1ccc(F)c(C(F)(F)F)c1
InChIInChI=1S/C14H11BrF4N2/c15-10-3-1-2-8(6-10)13(21-20)9-4-5-12(16)11(7-9)14(17,18)19/h1-7,13,21H,20H2
InChIKeyXMNZXFJTSCZQKE-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

[(3-chlorophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105289210
2-[[4-fluoro-3-(trifluoromethyl)phenyl]-hydrazinylmethyl]aniline
CID 107292299
[[4-fluoro-3-(trifluoromethyl)phenyl]-(2-iodophenyl)methyl]hydrazine
CID 107292549
[[4-bromo-3-(trifluoromethyl)phenyl]-(3-methylphenyl)methyl]hydrazine
CID 105284949
[[4-bromo-2-(trifluoromethyl)phenyl]-(3-chlorophenyl)methyl]hydrazine
CID 105212866
[(4-bromo-1-methylpyrazol-5-yl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105342188
[(3-fluoro-4-pyridinyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105335389
[(3-bromo-5-chlorophenyl)-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 107948177
[(3-bromo-4-fluorophenyl)-(3-chlorophenyl)methyl]hydrazine
CID 105264217
[[4-fluoro-3-(trifluoromethyl)phenyl]-(4-methylthiophen-3-yl)methyl]hydrazine
CID 107292364
[(3-bromophenyl)-phenylmethyl]hydrazine;toluene
CID 145340626
(3-bromo-5-fluorophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methanamine
CID 107289052

Frequently Asked Questions

What is the IUPAC name of [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine (CID 107292244) is [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine is NNC(c1cccc(Br)c1)c1ccc(F)c(C(F)(F)F)c1.
What is the InChIKey of [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is XMNZXFJTSCZQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrF4N2/c15-10-3-1-2-8(6-10)13(21-20)9-4-5-12(16)11(7-9)14(17,18)19/h1-7,13,21H,20H2.
What are the key properties of [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine?
[(3-bromophenyl)-[4-fluoro-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 [(3-bromophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 107292244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).