phenyl(trichloromethoxy)phosphinic acid

C7H6Cl3O3P — CID 88763731

IUPACphenyl(trichloromethoxy)phosphinic acid
SMILESO=P(O)(OC(Cl)(Cl)Cl)c1ccccc1
InChIInChI=1S/C7H6Cl3O3P/c8-7(9,10)13-14(11,12)6-4-2-1-3-5-6/h1-5H,(H,11,12)
InChIKeyZZAZISCPRBUTRI-UHFFFAOYSA-N
MW275.46 g/mol
LogP2.84
Rot. Bonds2

About phenyl(trichloromethoxy)phosphinic acid

phenyl(trichloromethoxy)phosphinic acid (PubChem CID 88763731) has the molecular formula C7H6Cl3O3P and a molecular weight of 275.46 g/mol. Its IUPAC name is phenyl(trichloromethoxy)phosphinic acid.

Molecular Properties

Compound Namephenyl(trichloromethoxy)phosphinic acid
PubChem CID88763731
Molecular FormulaC7H6Cl3O3P
Molecular Weight275.46 g/mol
Exact Mass273.91
IUPAC Namephenyl(trichloromethoxy)phosphinic acid
SMILESO=P(O)(OC(Cl)(Cl)Cl)c1ccccc1
InChIInChI=1S/C7H6Cl3O3P/c8-7(9,10)13-14(11,12)6-4-2-1-3-5-6/h1-5H,(H,11,12)
InChIKeyZZAZISCPRBUTRI-UHFFFAOYSA-N
XLogP2.84
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.46
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-aminoethoxy(phenyl)phosphinic acid
CID 23257414
[hydroxy(phenyl)phosphoryl]oxy-(trifluoromethyl)phosphinic acid
CID 118861926
phenylphosphonamidic acid
CID 18388605
2,2-dimethylpropoxy(phenyl)phosphinic acid
CID 54533084
phenyl(2,2,2-trifluoroethoxy)phosphinic acid
CID 118440971
[(2S)-2-aminopropanoyl]oxy-phenylphosphinic acid
CID 174823830
1-[(1-amino-1-chloroethyl)-phenylphosphoryl]-1-chloroethanamine
CID 168876205
ethoxycarbonyloxy(phenyl)phosphinic acid
CID 141287038
CID 66766975
CID 66766975
diphenylphosphinic acid chloride
CID 53401992
phenylphosphonic acid;phosphane
CID 157219344
phenylphosphonic acid;terbium
CID 175289814

Frequently Asked Questions

What is the IUPAC name of phenyl(trichloromethoxy)phosphinic acid?
The IUPAC name of phenyl(trichloromethoxy)phosphinic acid (CID 88763731) is phenyl(trichloromethoxy)phosphinic acid.
What is the SMILES notation for phenyl(trichloromethoxy)phosphinic acid?
The canonical SMILES for phenyl(trichloromethoxy)phosphinic acid is O=P(O)(OC(Cl)(Cl)Cl)c1ccccc1.
What is the InChIKey of phenyl(trichloromethoxy)phosphinic acid?
The InChIKey is ZZAZISCPRBUTRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl3O3P/c8-7(9,10)13-14(11,12)6-4-2-1-3-5-6/h1-5H,(H,11,12).
What are the key properties of phenyl(trichloromethoxy)phosphinic acid?
phenyl(trichloromethoxy)phosphinic acid has a molecular weight of 275.46 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(trichloromethoxy)phosphinic acid is sourced from PubChem (CID 88763731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).