1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid

C6H8Br3N2O4P — CID 174887327

IUPAC1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid
SMILESBrNNc1ccc(Br)cc1Br.O=P(O)(O)O
InChIInChI=1S/C6H5Br3N2.H3O4P/c7-4-1-2-6(10-11-9)5(8)3-4;1-5(2,3)4/h1-3,10-11H;(H3,1,2,3,4)
InChIKeyGQJGUJAOXIRLHW-UHFFFAOYSA-N
MW442.83 g/mol
LogP2.51
Rot. Bonds2

About 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid

1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid (PubChem CID 174887327) has the molecular formula C6H8Br3N2O4P and a molecular weight of 442.83 g/mol. Its IUPAC name is 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid.

Molecular Properties

Compound Name1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid
PubChem CID174887327
Molecular FormulaC6H8Br3N2O4P
Molecular Weight442.83 g/mol
Exact Mass439.78
IUPAC Name1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid
SMILESBrNNc1ccc(Br)cc1Br.O=P(O)(O)O
InChIInChI=1S/C6H5Br3N2.H3O4P/c7-4-1-2-6(10-11-9)5(8)3-4;1-5(2,3)4/h1-3,10-11H;(H3,1,2,3,4)
InChIKeyGQJGUJAOXIRLHW-UHFFFAOYSA-N
XLogP2.51
TPSA101.82 Ų
H-Bond Donors5
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.83
LogP ≤ 52.51
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-bromo-2-(2,3,5-tribromophenyl)hydrazine;phosphoric acid
CID 174886883
N'-(2,4-dibromophenyl)-2-phenylacetohydrazide
CID 5001821
N-(2,4-dibromophenyl)-4-methylbenzamide
CID 2707201
4-bromo-N-(2,4-dibromophenyl)-2-fluorobenzamide
CID 26691585
3-(2,4-dibromoanilino)-3-oxopropanoic acid
CID 62230789
5-bromo-2-(2,4-dibromoanilino)benzoic acid
CID 12925320
3-bromo-N-(2,4-dibromophenyl)-4-fluorobenzamide
CID 107951894
4-(2,4-dibromoanilino)-2-methyl-4-oxobut-2-enoate
CID 4748169
phosphoric acid;(2,4,6-tribromophenyl)hydrazine
CID 138620212
1-(2,4-dibromophenyl)-3-ethylurea
CID 102364568
N-(2,4-dibromophenyl)-2,3-difluorobenzamide
CID 55099912
4-amino-N-(2,4-dibromophenyl)-3,5-difluorobenzamide
CID 63185804

Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid?
The IUPAC name of 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid (CID 174887327) is 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid.
What is the SMILES notation for 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid?
The canonical SMILES for 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid is BrNNc1ccc(Br)cc1Br.O=P(O)(O)O.
What is the InChIKey of 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid?
The InChIKey is GQJGUJAOXIRLHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Br3N2.H3O4P/c7-4-1-2-6(10-11-9)5(8)3-4;1-5(2,3)4/h1-3,10-11H;(H3,1,2,3,4).
What are the key properties of 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid?
1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid has a molecular weight of 442.83 g/mol, XLogP of 2.51, 2 rotatable bonds, 5 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-(2,4-dibromophenyl)hydrazine;phosphoric acid is sourced from PubChem (CID 174887327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).