benzoyloxyphosphinous acid

C7H7O3P — CID 175318524

IUPACbenzoyloxyphosphinous acid
SMILESO=C(OPO)c1ccccc1
InChIInChI=1S/C7H7O3P/c8-7(10-11-9)6-4-2-1-3-5-6/h1-5,9,11H
InChIKeyYNGDEVHSXHVEOV-UHFFFAOYSA-N
MW170.10 g/mol
LogP1.34
Rot. Bonds2

About benzoyloxyphosphinous acid

benzoyloxyphosphinous acid (PubChem CID 175318524) has the molecular formula C7H7O3P and a molecular weight of 170.10 g/mol. Its IUPAC name is benzoyloxyphosphinous acid.

Molecular Properties

Compound Namebenzoyloxyphosphinous acid
PubChem CID175318524
Molecular FormulaC7H7O3P
Molecular Weight170.10 g/mol
Exact Mass170.01
IUPAC Namebenzoyloxyphosphinous acid
SMILESO=C(OPO)c1ccccc1
InChIInChI=1S/C7H7O3P/c8-7(10-11-9)6-4-2-1-3-5-6/h1-5,9,11H
InChIKeyYNGDEVHSXHVEOV-UHFFFAOYSA-N
XLogP1.34
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.10
LogP ≤ 51.34
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

ethylphosphanyl benzoate
CID 70434522
argon;benzoyl benzenecarboperoxoate
CID 161437596
CID 19766641
CID 19766641
benzoyl benzenecarboperoxoate;hydron
CID 20524010
benzoyl benzenecarboperoxoate;trioxirane
CID 174834892
CID 157228504
CID 157228504
azanium benzenecarboperoxoate
CID 141076857
methyl benzoate;hydrate
CID 141218240
dibenzoyloxyboranyl benzoate
CID 139803166
[4-[4-(4-benzoyloxyphenoxy)phenoxy]phenyl] benzoate
CID 14669952
ethane;methoxymethane;methyl benzoate
CID 90999424
benzoyl benzoate;methylperoxymethane
CID 88758305

Frequently Asked Questions

What is the IUPAC name of benzoyloxyphosphinous acid?
The IUPAC name of benzoyloxyphosphinous acid (CID 175318524) is benzoyloxyphosphinous acid.
What is the SMILES notation for benzoyloxyphosphinous acid?
The canonical SMILES for benzoyloxyphosphinous acid is O=C(OPO)c1ccccc1.
What is the InChIKey of benzoyloxyphosphinous acid?
The InChIKey is YNGDEVHSXHVEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7O3P/c8-7(10-11-9)6-4-2-1-3-5-6/h1-5,9,11H.
What are the key properties of benzoyloxyphosphinous acid?
benzoyloxyphosphinous acid has a molecular weight of 170.10 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for benzoyloxyphosphinous acid is sourced from PubChem (CID 175318524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).