O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine

C12H9ClFNO — CID 142573176

IUPACO-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine
SMILESNOc1ccc(-c2ccccc2F)cc1Cl
InChIInChI=1S/C12H9ClFNO/c13-10-7-8(5-6-12(10)16-15)9-3-1-2-4-11(9)14/h1-7H,15H2
InChIKeyBPMFCLWREVKANO-UHFFFAOYSA-N
MW237.66 g/mol
LogP3.40
Rot. Bonds2

About O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine

O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine (PubChem CID 142573176) has the molecular formula C12H9ClFNO and a molecular weight of 237.66 g/mol. Its IUPAC name is O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine.

Molecular Properties

Compound NameO-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine
PubChem CID142573176
Molecular FormulaC12H9ClFNO
Molecular Weight237.66 g/mol
Exact Mass237.04
IUPAC NameO-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine
SMILESNOc1ccc(-c2ccccc2F)cc1Cl
InChIInChI=1S/C12H9ClFNO/c13-10-7-8(5-6-12(10)16-15)9-3-1-2-4-11(9)14/h1-7H,15H2
InChIKeyBPMFCLWREVKANO-UHFFFAOYSA-N
XLogP3.40
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.66
LogP ≤ 53.40
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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Related Compounds

1-[2-chloro-4-(2-fluorophenyl)phenyl]ethanamine
CID 82783615
2-chloro-5-(2-fluorophenyl)phenol
CID 46314345
2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene
CID 46312218
2-chloro-4-(2-fluorophenyl)benzonitrile
CID 46314397
2-[2-fluoro-4-(2-fluorophenyl)phenoxy]ethanamine
CID 163408392
1,4-bis(2-fluorophenyl)benzene
CID 58121760
methyl 2-chloro-4-(2-fluorophenyl)benzoate
CID 75488279
[5-(2-fluorophenyl)-2-methoxyphenyl]methanamine;hydrochloride
CID 171037272
2-fluoro-4-(2-fluorophenyl)-1-propoxybenzene
CID 174492898
[3-(3-chloro-4-methoxyphenyl)-4-fluorophenyl]methanamine
CID 54910650
O-(4-chloro-2-fluorophenyl)hydroxylamine
CID 130505440
1-fluoro-4-(2-fluorophenyl)-2-iodobenzene
CID 46313932

Frequently Asked Questions

What is the IUPAC name of O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine?
The IUPAC name of O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine (CID 142573176) is O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine.
What is the SMILES notation for O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine?
The canonical SMILES for O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine is NOc1ccc(-c2ccccc2F)cc1Cl.
What is the InChIKey of O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine?
The InChIKey is BPMFCLWREVKANO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO/c13-10-7-8(5-6-12(10)16-15)9-3-1-2-4-11(9)14/h1-7H,15H2.
What are the key properties of O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine?
O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine has a molecular weight of 237.66 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-chloro-4-(2-fluorophenyl)phenyl]hydroxylamine is sourced from PubChem (CID 142573176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).