O-(3-aminooxyphenyl)hydroxylamine

C6H8N2O2 — CID 118013291

IUPACO-(3-aminooxyphenyl)hydroxylamine
SMILESNOc1cccc(ON)c1
InChIInChI=1S/C6H8N2O2/c7-9-5-2-1-3-6(4-5)10-8/h1-4H,7-8H2
InChIKeyHJNPNLNDJDQJOE-UHFFFAOYSA-N
MW140.14 g/mol
LogP0.19
Rot. Bonds2

About O-(3-aminooxyphenyl)hydroxylamine

O-(3-aminooxyphenyl)hydroxylamine (PubChem CID 118013291) has the molecular formula C6H8N2O2 and a molecular weight of 140.14 g/mol. Its IUPAC name is O-(3-aminooxyphenyl)hydroxylamine.

Molecular Properties

Compound NameO-(3-aminooxyphenyl)hydroxylamine
PubChem CID118013291
Molecular FormulaC6H8N2O2
Molecular Weight140.14 g/mol
Exact Mass140.06
IUPAC NameO-(3-aminooxyphenyl)hydroxylamine
SMILESNOc1cccc(ON)c1
InChIInChI=1S/C6H8N2O2/c7-9-5-2-1-3-6(4-5)10-8/h1-4H,7-8H2
InChIKeyHJNPNLNDJDQJOE-UHFFFAOYSA-N
XLogP0.19
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.14
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(3-aminooxyphenyl)hydroxylamine?
The IUPAC name of O-(3-aminooxyphenyl)hydroxylamine (CID 118013291) is O-(3-aminooxyphenyl)hydroxylamine.
What is the SMILES notation for O-(3-aminooxyphenyl)hydroxylamine?
The canonical SMILES for O-(3-aminooxyphenyl)hydroxylamine is NOc1cccc(ON)c1.
What is the InChIKey of O-(3-aminooxyphenyl)hydroxylamine?
The InChIKey is HJNPNLNDJDQJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2/c7-9-5-2-1-3-6(4-5)10-8/h1-4H,7-8H2.
What are the key properties of O-(3-aminooxyphenyl)hydroxylamine?
O-(3-aminooxyphenyl)hydroxylamine has a molecular weight of 140.14 g/mol, XLogP of 0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-(3-aminooxyphenyl)hydroxylamine is sourced from PubChem (CID 118013291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).