1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride

C6H5Br4ClN2 — CID 174886898

IUPAC1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride
SMILESBrNNc1cc(Br)c(Br)c(Br)c1.Cl
InChIInChI=1S/C6H4Br4N2.ClH/c7-4-1-3(11-12-10)2-5(8)6(4)9;/h1-2,11-12H;1H
InChIKeyFMCVPYUARJHFOO-UHFFFAOYSA-N
MW460.19 g/mol
LogP4.62
Rot. Bonds2

About 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride

1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride (PubChem CID 174886898) has the molecular formula C6H5Br4ClN2 and a molecular weight of 460.19 g/mol. Its IUPAC name is 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride.

Molecular Properties

Compound Name1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride
PubChem CID174886898
Molecular FormulaC6H5Br4ClN2
Molecular Weight460.19 g/mol
Exact Mass455.69
IUPAC Name1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride
SMILESBrNNc1cc(Br)c(Br)c(Br)c1.Cl
InChIInChI=1S/C6H4Br4N2.ClH/c7-4-1-3(11-12-10)2-5(8)6(4)9;/h1-2,11-12H;1H
InChIKeyFMCVPYUARJHFOO-UHFFFAOYSA-N
XLogP4.62
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.19
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride?
The IUPAC name of 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride (CID 174886898) is 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride.
What is the SMILES notation for 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride?
The canonical SMILES for 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride is BrNNc1cc(Br)c(Br)c(Br)c1.Cl.
What is the InChIKey of 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride?
The InChIKey is FMCVPYUARJHFOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Br4N2.ClH/c7-4-1-3(11-12-10)2-5(8)6(4)9;/h1-2,11-12H;1H.
What are the key properties of 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride?
1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride has a molecular weight of 460.19 g/mol, XLogP of 4.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-(3,4,5-tribromophenyl)hydrazine;hydrochloride is sourced from PubChem (CID 174886898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).