5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol

C8H9Br2N3O — CID 138631109

IUPAC5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol
SMILESN/C=C(\NN)c1cc(O)c(Br)cc1Br
InChIInChI=1S/C8H9Br2N3O/c9-5-2-6(10)8(14)1-4(5)7(3-11)13-12/h1-3,13-14H,11-12H2/b7-3-
InChIKeyBHVKWXMIWSJFIG-CLTKARDFSA-N
MW322.99 g/mol
LogP1.64
Rot. Bonds2

About 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol

5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol (PubChem CID 138631109) has the molecular formula C8H9Br2N3O and a molecular weight of 322.99 g/mol. Its IUPAC name is 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol.

Molecular Properties

Compound Name5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol
PubChem CID138631109
Molecular FormulaC8H9Br2N3O
Molecular Weight322.99 g/mol
Exact Mass320.91
IUPAC Name5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol
SMILESN/C=C(\NN)c1cc(O)c(Br)cc1Br
InChIInChI=1S/C8H9Br2N3O/c9-5-2-6(10)8(14)1-4(5)7(3-11)13-12/h1-3,13-14H,11-12H2/b7-3-
InChIKeyBHVKWXMIWSJFIG-CLTKARDFSA-N
XLogP1.64
TPSA84.30 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.99
LogP ≤ 51.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol?
The IUPAC name of 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol (CID 138631109) is 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol.
What is the SMILES notation for 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol?
The canonical SMILES for 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol is N/C=C(\NN)c1cc(O)c(Br)cc1Br.
What is the InChIKey of 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol?
The InChIKey is BHVKWXMIWSJFIG-CLTKARDFSA-N. The full InChI is InChI=1S/C8H9Br2N3O/c9-5-2-6(10)8(14)1-4(5)7(3-11)13-12/h1-3,13-14H,11-12H2/b7-3-.
What are the key properties of 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol?
5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol has a molecular weight of 322.99 g/mol, XLogP of 1.64, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-2-amino-1-hydrazinylethenyl]-2,4-dibromophenol is sourced from PubChem (CID 138631109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).