2-bromo-5-(fluoroamino)phenol

C6H5BrFNO — CID 141044268

IUPAC2-bromo-5-(fluoroamino)phenol
SMILESOc1cc(NF)ccc1Br
InChIInChI=1S/C6H5BrFNO/c7-5-2-1-4(9-8)3-6(5)10/h1-3,9-10H
InChIKeyMOYXZWITUGOECA-UHFFFAOYSA-N
MW206.01 g/mol
LogP2.45
Rot. Bonds1

About 2-bromo-5-(fluoroamino)phenol

2-bromo-5-(fluoroamino)phenol (PubChem CID 141044268) has the molecular formula C6H5BrFNO and a molecular weight of 206.01 g/mol. Its IUPAC name is 2-bromo-5-(fluoroamino)phenol.

Molecular Properties

Compound Name2-bromo-5-(fluoroamino)phenol
PubChem CID141044268
Molecular FormulaC6H5BrFNO
Molecular Weight206.01 g/mol
Exact Mass204.95
IUPAC Name2-bromo-5-(fluoroamino)phenol
SMILESOc1cc(NF)ccc1Br
InChIInChI=1S/C6H5BrFNO/c7-5-2-1-4(9-8)3-6(5)10/h1-3,9-10H
InChIKeyMOYXZWITUGOECA-UHFFFAOYSA-N
XLogP2.45
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.01
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(fluoroamino)phenol?
The IUPAC name of 2-bromo-5-(fluoroamino)phenol (CID 141044268) is 2-bromo-5-(fluoroamino)phenol.
What is the SMILES notation for 2-bromo-5-(fluoroamino)phenol?
The canonical SMILES for 2-bromo-5-(fluoroamino)phenol is Oc1cc(NF)ccc1Br.
What is the InChIKey of 2-bromo-5-(fluoroamino)phenol?
The InChIKey is MOYXZWITUGOECA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5BrFNO/c7-5-2-1-4(9-8)3-6(5)10/h1-3,9-10H.
What are the key properties of 2-bromo-5-(fluoroamino)phenol?
2-bromo-5-(fluoroamino)phenol has a molecular weight of 206.01 g/mol, XLogP of 2.45, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(fluoroamino)phenol is sourced from PubChem (CID 141044268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).