2-[(E)-methoxyiminomethyl]phenol

C8H9NO2 — CID 135542888

IUPAC2-[(E)-methoxyiminomethyl]phenol
SMILESCO/N=C/c1ccccc1O
InChIInChI=1S/C8H9NO2/c1-11-9-6-7-4-2-3-5-8(7)10/h2-6,10H,1H3/b9-6+
InChIKeyYCGAFVMCJLAIGM-RMKNXTFCSA-N
MW151.16 g/mol
LogP1.37
Rot. Bonds2

About 2-[(E)-methoxyiminomethyl]phenol

2-[(E)-methoxyiminomethyl]phenol (PubChem CID 135542888) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 2-[(E)-methoxyiminomethyl]phenol.

Molecular Properties

Compound Name2-[(E)-methoxyiminomethyl]phenol
PubChem CID135542888
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name2-[(E)-methoxyiminomethyl]phenol
SMILESCO/N=C/c1ccccc1O
InChIInChI=1S/C8H9NO2/c1-11-9-6-7-4-2-3-5-8(7)10/h2-6,10H,1H3/b9-6+
InChIKeyYCGAFVMCJLAIGM-RMKNXTFCSA-N
XLogP1.37
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 51.37
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-[(E)-methoxyiminomethyl]phenol?
The IUPAC name of 2-[(E)-methoxyiminomethyl]phenol (CID 135542888) is 2-[(E)-methoxyiminomethyl]phenol.
What is the SMILES notation for 2-[(E)-methoxyiminomethyl]phenol?
The canonical SMILES for 2-[(E)-methoxyiminomethyl]phenol is CO/N=C/c1ccccc1O.
What is the InChIKey of 2-[(E)-methoxyiminomethyl]phenol?
The InChIKey is YCGAFVMCJLAIGM-RMKNXTFCSA-N. The full InChI is InChI=1S/C8H9NO2/c1-11-9-6-7-4-2-3-5-8(7)10/h2-6,10H,1H3/b9-6+.
What are the key properties of 2-[(E)-methoxyiminomethyl]phenol?
2-[(E)-methoxyiminomethyl]phenol has a molecular weight of 151.16 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-methoxyiminomethyl]phenol is sourced from PubChem (CID 135542888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).