2-(3-chlorophenyl)-2-methoxyiminoethanol

C9H10ClNO2 — CID 54343986

IUPAC2-(3-chlorophenyl)-2-methoxyiminoethanol
SMILESCON=C(CO)c1cccc(Cl)c1
InChIInChI=1S/C9H10ClNO2/c1-13-11-9(6-12)7-3-2-4-8(10)5-7/h2-5,12H,6H2,1H3
InChIKeyUAZCEFISJFBYKF-UHFFFAOYSA-N
MW199.64 g/mol
LogP1.68
Rot. Bonds3

About 2-(3-chlorophenyl)-2-methoxyiminoethanol

2-(3-chlorophenyl)-2-methoxyiminoethanol (PubChem CID 54343986) has the molecular formula C9H10ClNO2 and a molecular weight of 199.64 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-2-methoxyiminoethanol.

Molecular Properties

Compound Name2-(3-chlorophenyl)-2-methoxyiminoethanol
PubChem CID54343986
Molecular FormulaC9H10ClNO2
Molecular Weight199.64 g/mol
Exact Mass199.04
IUPAC Name2-(3-chlorophenyl)-2-methoxyiminoethanol
SMILESCON=C(CO)c1cccc(Cl)c1
InChIInChI=1S/C9H10ClNO2/c1-13-11-9(6-12)7-3-2-4-8(10)5-7/h2-5,12H,6H2,1H3
InChIKeyUAZCEFISJFBYKF-UHFFFAOYSA-N
XLogP1.68
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-2-methoxyiminoethanol?
The IUPAC name of 2-(3-chlorophenyl)-2-methoxyiminoethanol (CID 54343986) is 2-(3-chlorophenyl)-2-methoxyiminoethanol.
What is the SMILES notation for 2-(3-chlorophenyl)-2-methoxyiminoethanol?
The canonical SMILES for 2-(3-chlorophenyl)-2-methoxyiminoethanol is CON=C(CO)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-2-methoxyiminoethanol?
The InChIKey is UAZCEFISJFBYKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO2/c1-13-11-9(6-12)7-3-2-4-8(10)5-7/h2-5,12H,6H2,1H3.
What are the key properties of 2-(3-chlorophenyl)-2-methoxyiminoethanol?
2-(3-chlorophenyl)-2-methoxyiminoethanol has a molecular weight of 199.64 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-2-methoxyiminoethanol is sourced from PubChem (CID 54343986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).