4-chloro-2-(methoxyiminomethyl)phenol

C8H8ClNO2 — CID 135970768

IUPAC4-chloro-2-(methoxyiminomethyl)phenol
SMILESCON=Cc1cc(Cl)ccc1O
InChIInChI=1S/C8H8ClNO2/c1-12-10-5-6-4-7(9)2-3-8(6)11/h2-5,11H,1H3
InChIKeyMYQYRZPTVVLZHQ-UHFFFAOYSA-N
MW185.61 g/mol
LogP2.03
Rot. Bonds2

About 4-chloro-2-(methoxyiminomethyl)phenol

4-chloro-2-(methoxyiminomethyl)phenol (PubChem CID 135970768) has the molecular formula C8H8ClNO2 and a molecular weight of 185.61 g/mol. Its IUPAC name is 4-chloro-2-(methoxyiminomethyl)phenol.

Molecular Properties

Compound Name4-chloro-2-(methoxyiminomethyl)phenol
PubChem CID135970768
Molecular FormulaC8H8ClNO2
Molecular Weight185.61 g/mol
Exact Mass185.02
IUPAC Name4-chloro-2-(methoxyiminomethyl)phenol
SMILESCON=Cc1cc(Cl)ccc1O
InChIInChI=1S/C8H8ClNO2/c1-12-10-5-6-4-7(9)2-3-8(6)11/h2-5,11H,1H3
InChIKeyMYQYRZPTVVLZHQ-UHFFFAOYSA-N
XLogP2.03
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.61
LogP ≤ 52.03
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 4-chloro-2-(methoxyiminomethyl)phenol?
The IUPAC name of 4-chloro-2-(methoxyiminomethyl)phenol (CID 135970768) is 4-chloro-2-(methoxyiminomethyl)phenol.
What is the SMILES notation for 4-chloro-2-(methoxyiminomethyl)phenol?
The canonical SMILES for 4-chloro-2-(methoxyiminomethyl)phenol is CON=Cc1cc(Cl)ccc1O.
What is the InChIKey of 4-chloro-2-(methoxyiminomethyl)phenol?
The InChIKey is MYQYRZPTVVLZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClNO2/c1-12-10-5-6-4-7(9)2-3-8(6)11/h2-5,11H,1H3.
What are the key properties of 4-chloro-2-(methoxyiminomethyl)phenol?
4-chloro-2-(methoxyiminomethyl)phenol has a molecular weight of 185.61 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(methoxyiminomethyl)phenol is sourced from PubChem (CID 135970768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).