6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol

C19H15NO2 — CID 135457991

IUPAC6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol
SMILESO/N=C/c1ccc(-c2ccccc2)c(-c2ccccc2)c1O
InChIInChI=1S/C19H15NO2/c21-19-16(13-20-22)11-12-17(14-7-3-1-4-8-14)18(19)15-9-5-2-6-10-15/h1-13,21-22H/b20-13+
InChIKeyRBSPTCQSWKXPGH-DEDYPNTBSA-N
MW289.33 g/mol
LogP4.53
Rot. Bonds3

About 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol

6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol (PubChem CID 135457991) has the molecular formula C19H15NO2 and a molecular weight of 289.33 g/mol. Its IUPAC name is 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol.

Molecular Properties

Compound Name6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol
PubChem CID135457991
Molecular FormulaC19H15NO2
Molecular Weight289.33 g/mol
Exact Mass289.11
IUPAC Name6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol
SMILESO/N=C/c1ccc(-c2ccccc2)c(-c2ccccc2)c1O
InChIInChI=1S/C19H15NO2/c21-19-16(13-20-22)11-12-17(14-7-3-1-4-8-14)18(19)15-9-5-2-6-10-15/h1-13,21-22H/b20-13+
InChIKeyRBSPTCQSWKXPGH-DEDYPNTBSA-N
XLogP4.53
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_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 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol?
The IUPAC name of 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol (CID 135457991) is 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol.
What is the SMILES notation for 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol?
The canonical SMILES for 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol is O/N=C/c1ccc(-c2ccccc2)c(-c2ccccc2)c1O.
What is the InChIKey of 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol?
The InChIKey is RBSPTCQSWKXPGH-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H15NO2/c21-19-16(13-20-22)11-12-17(14-7-3-1-4-8-14)18(19)15-9-5-2-6-10-15/h1-13,21-22H/b20-13+.
What are the key properties of 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol?
6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol has a molecular weight of 289.33 g/mol, XLogP of 4.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(E)-hydroxyiminomethyl]-2,3-diphenylphenol is sourced from PubChem (CID 135457991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).