methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid

C15H15O4P — CID 141381447

IUPACmethoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid
SMILESCOP(=O)(O)c1ccccc1C(=O)c1ccccc1C
InChIInChI=1S/C15H15O4P/c1-11-7-3-4-8-12(11)15(16)13-9-5-6-10-14(13)20(17,18)19-2/h3-10H,1-2H3,(H,17,18)
InChIKeyQAUPKGWVCDCPLU-UHFFFAOYSA-N
MW290.26 g/mol
LogP2.68
Rot. Bonds4

About methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid

methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid (PubChem CID 141381447) has the molecular formula C15H15O4P and a molecular weight of 290.26 g/mol. Its IUPAC name is methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid.

Molecular Properties

Compound Namemethoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid
PubChem CID141381447
Molecular FormulaC15H15O4P
Molecular Weight290.26 g/mol
Exact Mass290.07
IUPAC Namemethoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid
SMILESCOP(=O)(O)c1ccccc1C(=O)c1ccccc1C
InChIInChI=1S/C15H15O4P/c1-11-7-3-4-8-12(11)15(16)13-9-5-6-10-14(13)20(17,18)19-2/h3-10H,1-2H3,(H,17,18)
InChIKeyQAUPKGWVCDCPLU-UHFFFAOYSA-N
XLogP2.68
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.26
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

[2-(2-methylbenzoyl)phenyl]-(2-methylphenyl)methanone
CID 15597717
phosphono 2-methylbenzoate
CID 66728080
(2-methylphenyl)phosphonic acid;dihydrochloride
CID 70471914
bis(2-methylbenzoyl)phosphoryl-(2-methylphenyl)methanone
CID 18353869
ethane;methoxymethane;1-(2-methylphenyl)ethanone
CID 90975384
[2-[2-[2-(2-methylbenzoyl)phenyl]ethyl]phenyl]-(2-methylphenyl)methanone
CID 117071524
methyl 2-[[2-(2-methylbenzoyl)phenyl]methyl]benzoate
CID 10545389
(2-methylphenyl)-propan-2-yloxyphosphinic acid
CID 139679819
(5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone
CID 82084658
(2-methylphenyl)-(4-methylphenyl)methanone
CID 6613295
1-(2-methylphenyl)ethenylphosphonic acid
CID 3021132
ethane;methane;methyl 2-methylbenzoate
CID 168902289

Frequently Asked Questions

What is the IUPAC name of methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid?
The IUPAC name of methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid (CID 141381447) is methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid.
What is the SMILES notation for methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid?
The canonical SMILES for methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid is COP(=O)(O)c1ccccc1C(=O)c1ccccc1C.
What is the InChIKey of methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid?
The InChIKey is QAUPKGWVCDCPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15O4P/c1-11-7-3-4-8-12(11)15(16)13-9-5-6-10-14(13)20(17,18)19-2/h3-10H,1-2H3,(H,17,18).
What are the key properties of methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid?
methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid has a molecular weight of 290.26 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-[2-(2-methylbenzoyl)phenyl]phosphinic acid is sourced from PubChem (CID 141381447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).