O-[4-(4-bromophenyl)phenyl]hydroxylamine

C12H10BrNO — CID 71082038

IUPACO-[4-(4-bromophenyl)phenyl]hydroxylamine
SMILESNOc1ccc(-c2ccc(Br)cc2)cc1
InChIInChI=1S/C12H10BrNO/c13-11-5-1-9(2-6-11)10-3-7-12(15-14)8-4-10/h1-8H,14H2
InChIKeyMQTKHPSAMJJDHD-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.37
Rot. Bonds2

About O-[4-(4-bromophenyl)phenyl]hydroxylamine

O-[4-(4-bromophenyl)phenyl]hydroxylamine (PubChem CID 71082038) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is O-[4-(4-bromophenyl)phenyl]hydroxylamine.

Molecular Properties

Compound NameO-[4-(4-bromophenyl)phenyl]hydroxylamine
PubChem CID71082038
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC NameO-[4-(4-bromophenyl)phenyl]hydroxylamine
SMILESNOc1ccc(-c2ccc(Br)cc2)cc1
InChIInChI=1S/C12H10BrNO/c13-11-5-1-9(2-6-11)10-3-7-12(15-14)8-4-10/h1-8H,14H2
InChIKeyMQTKHPSAMJJDHD-UHFFFAOYSA-N
XLogP3.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.12
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of O-[4-(4-bromophenyl)phenyl]hydroxylamine?
The IUPAC name of O-[4-(4-bromophenyl)phenyl]hydroxylamine (CID 71082038) is O-[4-(4-bromophenyl)phenyl]hydroxylamine.
What is the SMILES notation for O-[4-(4-bromophenyl)phenyl]hydroxylamine?
The canonical SMILES for O-[4-(4-bromophenyl)phenyl]hydroxylamine is NOc1ccc(-c2ccc(Br)cc2)cc1.
What is the InChIKey of O-[4-(4-bromophenyl)phenyl]hydroxylamine?
The InChIKey is MQTKHPSAMJJDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c13-11-5-1-9(2-6-11)10-3-7-12(15-14)8-4-10/h1-8H,14H2.
What are the key properties of O-[4-(4-bromophenyl)phenyl]hydroxylamine?
O-[4-(4-bromophenyl)phenyl]hydroxylamine has a molecular weight of 264.12 g/mol, XLogP of 3.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-[4-(4-bromophenyl)phenyl]hydroxylamine is sourced from PubChem (CID 71082038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).