[(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine

C13H9Br2F3N2 — CID 106945532

IUPAC[(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)cc1Br)c1c(F)ccc(Br)c1F
InChIInChI=1S/C13H9Br2F3N2/c14-8-3-4-10(17)11(12(8)18)13(20-19)7-2-1-6(16)5-9(7)15/h1-5,13,20H,19H2
InChIKeyGYQBTTQMNMTCBR-UHFFFAOYSA-N
MW410.03 g/mol
LogP4.18
Rot. Bonds3

About [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine

[(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine (PubChem CID 106945532) has the molecular formula C13H9Br2F3N2 and a molecular weight of 410.03 g/mol. Its IUPAC name is [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine
PubChem CID106945532
Molecular FormulaC13H9Br2F3N2
Molecular Weight410.03 g/mol
Exact Mass407.91
IUPAC Name[(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine
SMILESNNC(c1ccc(F)cc1Br)c1c(F)ccc(Br)c1F
InChIInChI=1S/C13H9Br2F3N2/c14-8-3-4-10(17)11(12(8)18)13(20-19)7-2-1-6(16)5-9(7)15/h1-5,13,20H,19H2
InChIKeyGYQBTTQMNMTCBR-UHFFFAOYSA-N
XLogP4.18
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.03
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2-bromo-4-fluorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105304939
[(3-bromo-2,6-difluorophenyl)-(2-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 106945408
2-[(3-bromo-2,6-difluorophenyl)-hydrazinylmethyl]aniline
CID 106945317
[(2-bromo-4-fluorophenyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 105302771
[(3-bromo-2,6-difluorophenyl)-(2-methylphenyl)methyl]hydrazine
CID 106945251
[(3-bromo-2,6-difluorophenyl)-(2-chloro-3-methylphenyl)methyl]hydrazine
CID 106945494
(3-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methanamine
CID 106942443
1-(3-bromo-2,6-difluorophenyl)-1-(2-chloro-4-fluorophenyl)-N-methylmethanamine
CID 106942434
[(2-bromo-4-chlorophenyl)-(3,5-difluorophenyl)methyl]hydrazine
CID 107996986
[(4-bromo-2,6-difluorophenyl)-(2,4-difluorophenyl)methyl]hydrazine
CID 105303288
[(4-bromo-3-chloro-2-fluorophenyl)-(2-bromo-4-chlorophenyl)methyl]hydrazine
CID 107997423
[(2-bromo-4-fluorophenyl)-(3-bromofuran-2-yl)methyl]hydrazine
CID 105309112

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine?
The IUPAC name of [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine (CID 106945532) is [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine is NNC(c1ccc(F)cc1Br)c1c(F)ccc(Br)c1F.
What is the InChIKey of [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine?
The InChIKey is GYQBTTQMNMTCBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Br2F3N2/c14-8-3-4-10(17)11(12(8)18)13(20-19)7-2-1-6(16)5-9(7)15/h1-5,13,20H,19H2.
What are the key properties of [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine?
[(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine has a molecular weight of 410.03 g/mol, XLogP of 4.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-2,6-difluorophenyl)-(2-bromo-4-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 106945532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).