1-(3,5-dibromophenyl)heptylhydrazine

C13H20Br2N2 — CID 107978976

IUPAC1-(3,5-dibromophenyl)heptylhydrazine
SMILESCCCCCCC(NN)c1cc(Br)cc(Br)c1
InChIInChI=1S/C13H20Br2N2/c1-2-3-4-5-6-13(17-16)10-7-11(14)9-12(15)8-10/h7-9,13,17H,2-6,16H2,1H3
InChIKeyZTXBUTACUBIAEX-UHFFFAOYSA-N
MW364.13 g/mol
LogP4.69
Rot. Bonds7

About 1-(3,5-dibromophenyl)heptylhydrazine

1-(3,5-dibromophenyl)heptylhydrazine (PubChem CID 107978976) has the molecular formula C13H20Br2N2 and a molecular weight of 364.13 g/mol. Its IUPAC name is 1-(3,5-dibromophenyl)heptylhydrazine.

Molecular Properties

Compound Name1-(3,5-dibromophenyl)heptylhydrazine
PubChem CID107978976
Molecular FormulaC13H20Br2N2
Molecular Weight364.13 g/mol
Exact Mass362.00
IUPAC Name1-(3,5-dibromophenyl)heptylhydrazine
SMILESCCCCCCC(NN)c1cc(Br)cc(Br)c1
InChIInChI=1S/C13H20Br2N2/c1-2-3-4-5-6-13(17-16)10-7-11(14)9-12(15)8-10/h7-9,13,17H,2-6,16H2,1H3
InChIKeyZTXBUTACUBIAEX-UHFFFAOYSA-N
XLogP4.69
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.13
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(3,5-dibromophenyl)pentylhydrazine
CID 107978974
1-(3-bromo-5-fluorophenyl)decylhydrazine
CID 105238624
1-(3-bromo-5-methylphenyl)pentylhydrazine
CID 105293715
1-(3,5-difluorophenyl)hexylhydrazine
CID 105207948
1-(3-bromo-5-methylphenyl)-N-methylheptan-1-amine
CID 115833289
1-(4-bromo-3-chlorophenyl)undecylhydrazine
CID 105298371
1-(4-bromo-3-fluorophenyl)heptylhydrazine
CID 105294043
1-(4-bromo-3-fluorophenyl)nonylhydrazine
CID 105294452
[(1S)-1-phenyldecyl]hydrazine
CID 124596381
1-(4-methylphenyl)heptylhydrazine
CID 105194415
1-(3-bromo-5-fluorophenyl)-N-ethylnonan-1-amine
CID 66424848
1-(4-bromo-2-methylphenyl)undecylhydrazine
CID 105298297

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dibromophenyl)heptylhydrazine?
The IUPAC name of 1-(3,5-dibromophenyl)heptylhydrazine (CID 107978976) is 1-(3,5-dibromophenyl)heptylhydrazine.
What is the SMILES notation for 1-(3,5-dibromophenyl)heptylhydrazine?
The canonical SMILES for 1-(3,5-dibromophenyl)heptylhydrazine is CCCCCCC(NN)c1cc(Br)cc(Br)c1.
What is the InChIKey of 1-(3,5-dibromophenyl)heptylhydrazine?
The InChIKey is ZTXBUTACUBIAEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20Br2N2/c1-2-3-4-5-6-13(17-16)10-7-11(14)9-12(15)8-10/h7-9,13,17H,2-6,16H2,1H3.
What are the key properties of 1-(3,5-dibromophenyl)heptylhydrazine?
1-(3,5-dibromophenyl)heptylhydrazine has a molecular weight of 364.13 g/mol, XLogP of 4.69, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dibromophenyl)heptylhydrazine is sourced from PubChem (CID 107978976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).