O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride

C7H9Cl2NO — CID 173447819

IUPACO-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride
SMILESCc1cccc(ON)c1Cl.Cl
InChIInChI=1S/C7H8ClNO.ClH/c1-5-3-2-4-6(10-9)7(5)8;/h2-4H,9H2,1H3;1H
InChIKeyUDKLRRRPUMJATL-UHFFFAOYSA-N
MW194.06 g/mol
LogP2.32
Rot. Bonds1

About O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride

O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride (PubChem CID 173447819) has the molecular formula C7H9Cl2NO and a molecular weight of 194.06 g/mol. Its IUPAC name is O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride.

Molecular Properties

Compound NameO-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride
PubChem CID173447819
Molecular FormulaC7H9Cl2NO
Molecular Weight194.06 g/mol
Exact Mass193.01
IUPAC NameO-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride
SMILESCc1cccc(ON)c1Cl.Cl
InChIInChI=1S/C7H8ClNO.ClH/c1-5-3-2-4-6(10-9)7(5)8;/h2-4H,9H2,1H3;1H
InChIKeyUDKLRRRPUMJATL-UHFFFAOYSA-N
XLogP2.32
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.06
LogP ≤ 52.32
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-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride?
The IUPAC name of O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride (CID 173447819) is O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride.
What is the SMILES notation for O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride?
The canonical SMILES for O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride is Cc1cccc(ON)c1Cl.Cl.
What is the InChIKey of O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride?
The InChIKey is UDKLRRRPUMJATL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO.ClH/c1-5-3-2-4-6(10-9)7(5)8;/h2-4H,9H2,1H3;1H.
What are the key properties of O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride?
O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride has a molecular weight of 194.06 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-(2-chloro-3-methylphenyl)hydroxylamine;hydrochloride is sourced from PubChem (CID 173447819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).